N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride

C13H27Cl2N3O2 — CID 119477299

IUPACN-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride
SMILESCCN1CCOC(C(=O)NC2CCC(N)CC2)C1.Cl.Cl
InChIInChI=1S/C13H25N3O2.2ClH/c1-2-16-7-8-18-12(9-16)13(17)15-11-5-3-10(14)4-6-11;;/h10-12H,2-9,14H2,1H3,(H,15,17);2*1H
InChIKeyVRDVDPLJQFDMJP-UHFFFAOYSA-N
MW328.28 g/mol
LogP0.94
Rot. Bonds3

About N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride

N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride (PubChem CID 119477299) has the molecular formula C13H27Cl2N3O2 and a molecular weight of 328.28 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride
PubChem CID119477299
Molecular FormulaC13H27Cl2N3O2
Molecular Weight328.28 g/mol
Exact Mass327.15
IUPAC NameN-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride
SMILESCCN1CCOC(C(=O)NC2CCC(N)CC2)C1.Cl.Cl
InChIInChI=1S/C13H25N3O2.2ClH/c1-2-16-7-8-18-12(9-16)13(17)15-11-5-3-10(14)4-6-11;;/h10-12H,2-9,14H2,1H3,(H,15,17);2*1H
InChIKeyVRDVDPLJQFDMJP-UHFFFAOYSA-N
XLogP0.94
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.28
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride 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

4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride
CID 119507639
4-ethylmorpholine-2-carboxylate
CID 127053688
4-ethyl-N-[2-(methylamino)ethyl]morpholine-2-carboxamide
CID 119502673
methyl 4-ethylmorpholine-2-carboxylate
CID 78926280
N-(1-amino-2-cyclopropylpropan-2-yl)-4-ethylmorpholine-2-carboxamide
CID 119574545
cycloheptyl-(4-ethylmorpholin-2-yl)methanone
CID 82931691
N-cyclopropyl-4-[2-[(4-methylphenyl)methylamino]-2-oxoethyl]morpholine-2-carboxamide
CID 163352376
N-(1-amino-4-methylpentan-2-yl)-4-ethylmorpholine-2-carboxamide
CID 119587494
N-cyclopropyl-4-[(3,4-difluorophenyl)methyl]morpholine-2-carboxamide
CID 155981047
tert-butyl 2-(cyclopropylcarbamoyl)morpholine-4-carboxylate
CID 59494690
3-amino-N-(1-ethylpiperidin-3-yl)cyclopentane-1-carboxamide;dihydrochloride
CID 119862380
(2S)-N-cyclopentyl-4-[(1,3-dimethylpyrazol-4-yl)methyl]morpholine-2-carboxamide
CID 92633348

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride?
The IUPAC name of N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride (CID 119477299) is N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride.
What is the SMILES notation for N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride?
The canonical SMILES for N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride is CCN1CCOC(C(=O)NC2CCC(N)CC2)C1.Cl.Cl.
What is the InChIKey of N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride?
The InChIKey is VRDVDPLJQFDMJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2.2ClH/c1-2-16-7-8-18-12(9-16)13(17)15-11-5-3-10(14)4-6-11;;/h10-12H,2-9,14H2,1H3,(H,15,17);2*1H.
What are the key properties of N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride?
N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride has a molecular weight of 328.28 g/mol, XLogP of 0.94, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride is sourced from PubChem (CID 119477299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).