2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide

C18H27N5O3 — CID 119129000

IUPAC2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide
SMILESCc1nn(C)c(N2CCOCC2)c1CNC(C)C(=O)NCc1ccco1
InChIInChI=1S/C18H27N5O3/c1-13-16(18(22(3)21-13)23-6-9-25-10-7-23)12-19-14(2)17(24)20-11-15-5-4-8-26-15/h4-5,8,14,19H,6-7,9-12H2,1-3H3,(H,20,24)
InChIKeyNGYOACUSZDCVBI-UHFFFAOYSA-N
MW361.45 g/mol
LogP0.95
Rot. Bonds7

About 2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide

2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide (PubChem CID 119129000) has the molecular formula C18H27N5O3 and a molecular weight of 361.45 g/mol. Its IUPAC name is 2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide
PubChem CID119129000
Molecular FormulaC18H27N5O3
Molecular Weight361.45 g/mol
Exact Mass361.21
IUPAC Name2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide
SMILESCc1nn(C)c(N2CCOCC2)c1CNC(C)C(=O)NCc1ccco1
InChIInChI=1S/C18H27N5O3/c1-13-16(18(22(3)21-13)23-6-9-25-10-7-23)12-19-14(2)17(24)20-11-15-5-4-8-26-15/h4-5,8,14,19H,6-7,9-12H2,1-3H3,(H,20,24)
InChIKeyNGYOACUSZDCVBI-UHFFFAOYSA-N
XLogP0.95
TPSA84.56 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide 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

(1S)-N-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methyl]-1-pyridin-3-ylethanamine
CID 94825212
N-(furan-2-ylmethyl)-2-[(4-methylphenyl)methylamino]propanamide
CID 43084593
2-(2-aminoethylamino)-N-(furan-2-ylmethyl)propanamide
CID 62139964
N-(furan-2-ylmethyl)-2-(pyridin-2-ylmethylamino)propanamide
CID 43084599
2-[[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]amino]acetic acid
CID 43466208
N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide
CID 20959394
2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide
CID 62641023
N-(furan-2-ylmethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]propanamide
CID 54914183
N-(furan-2-ylmethyl)-2-[(2-methyl-1,3-thiazol-4-yl)methylamino]propanamide
CID 61285392
2-[[1-(dimethylamino)cyclopentyl]methylamino]-N-(furan-2-ylmethyl)propanamide
CID 78915193
N-[(1,3-dimethyl-5-pyrrolidin-1-ylpyrazol-4-yl)methyl]propan-2-amine
CID 43280266
(2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide
CID 7437364

Frequently Asked Questions

What is the IUPAC name of 2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide?
The IUPAC name of 2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide (CID 119129000) is 2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide.
What is the SMILES notation for 2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide?
The canonical SMILES for 2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide is Cc1nn(C)c(N2CCOCC2)c1CNC(C)C(=O)NCc1ccco1.
What is the InChIKey of 2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide?
The InChIKey is NGYOACUSZDCVBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5O3/c1-13-16(18(22(3)21-13)23-6-9-25-10-7-23)12-19-14(2)17(24)20-11-15-5-4-8-26-15/h4-5,8,14,19H,6-7,9-12H2,1-3H3,(H,20,24).
What are the key properties of 2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide?
2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide has a molecular weight of 361.45 g/mol, XLogP of 0.95, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-N-(furan-2-ylmethyl)propanamide is sourced from PubChem (CID 119129000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).