2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride

C18H28ClN3O4 — CID 120930813

IUPAC2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride
SMILESCc1cc(C(=O)NC2CCN(C(=O)[C@H]3NCCO[C@@H]3C)CC2)c(C)o1.Cl
InChIInChI=1S/C18H27N3O4.ClH/c1-11-10-15(12(2)25-11)17(22)20-14-4-7-21(8-5-14)18(23)16-13(3)24-9-6-19-16;/h10,13-14,16,19H,4-9H2,1-3H3,(H,20,22);1H/t13-,16+;/m1./s1
InChIKeyIAMPIMZZDGMJQG-CACIRBSMSA-N
MW385.89 g/mol
LogP1.42
Rot. Bonds3

About 2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride

2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride (PubChem CID 120930813) has the molecular formula C18H28ClN3O4 and a molecular weight of 385.89 g/mol. Its IUPAC name is 2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride
PubChem CID120930813
Molecular FormulaC18H28ClN3O4
Molecular Weight385.89 g/mol
Exact Mass385.18
IUPAC Name2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride
SMILESCc1cc(C(=O)NC2CCN(C(=O)[C@H]3NCCO[C@@H]3C)CC2)c(C)o1.Cl
InChIInChI=1S/C18H27N3O4.ClH/c1-11-10-15(12(2)25-11)17(22)20-14-4-7-21(8-5-14)18(23)16-13(3)24-9-6-19-16;/h10,13-14,16,19H,4-9H2,1-3H3,(H,20,22);1H/t13-,16+;/m1./s1
InChIKeyIAMPIMZZDGMJQG-CACIRBSMSA-N
XLogP1.42
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.89
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide
CID 120930820
N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]thiophene-3-carboxamide;hydrochloride
CID 120928066
N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]cyclohexanecarboxamide;hydrochloride
CID 120928753
[4-(3-methylanilino)piperidin-1-yl]-[(2R,3S)-2-methylmorpholin-3-yl]methanone;dihydrochloride
CID 120942286
2,5-dimethyl-N-[1-(2-thiomorpholin-3-ylacetyl)piperidin-4-yl]furan-3-carboxamide;hydrochloride
CID 119938637
2,5-dimethyl-N-(2-methylpiperidin-4-yl)furan-3-carboxamide;hydrochloride
CID 120600731
N-[1-(9-aminobicyclo[3.3.1]nonane-3-carbonyl)piperidin-4-yl]-2,5-dimethylfuran-3-carboxamide;hydrochloride
CID 120988801
2,5-dimethyl-N-pyrrolidin-3-ylfuran-3-carboxamide
CID 43603617
[4-(3,4-dimethylphenoxy)piperidin-1-yl]-[(2R,3S)-2-methylmorpholin-3-yl]methanone
CID 120926045
2,5-dimethyl-N-piperidin-3-ylfuran-3-carboxamide;hydrochloride
CID 119427545
[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]-piperidin-1-ylmethanone;hydrochloride
CID 120919129
(4-tert-butylpiperidin-1-yl)-[(2R,3S)-2-methylmorpholin-3-yl]methanone;hydrochloride
CID 120929521

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride?
The IUPAC name of 2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride (CID 120930813) is 2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride.
What is the SMILES notation for 2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride?
The canonical SMILES for 2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride is Cc1cc(C(=O)NC2CCN(C(=O)[C@H]3NCCO[C@@H]3C)CC2)c(C)o1.Cl.
What is the InChIKey of 2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride?
The InChIKey is IAMPIMZZDGMJQG-CACIRBSMSA-N. The full InChI is InChI=1S/C18H27N3O4.ClH/c1-11-10-15(12(2)25-11)17(22)20-14-4-7-21(8-5-14)18(23)16-13(3)24-9-6-19-16;/h10,13-14,16,19H,4-9H2,1-3H3,(H,20,22);1H/t13-,16+;/m1./s1.
What are the key properties of 2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride?
2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride has a molecular weight of 385.89 g/mol, XLogP of 1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride is sourced from PubChem (CID 120930813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).