N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide

C16H31N3O — CID 79548705

IUPACN-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide
SMILESCCCNC(=O)CCNC1CCCCC1C1CCCN1
InChIInChI=1S/C16H31N3O/c1-2-10-19-16(20)9-12-18-14-7-4-3-6-13(14)15-8-5-11-17-15/h13-15,17-18H,2-12H2,1H3,(H,19,20)
InChIKeyGNUOSSDFHVPDLT-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.80
Rot. Bonds7

About N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide

N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide (PubChem CID 79548705) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide.

Molecular Properties

Compound NameN-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide
PubChem CID79548705
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC NameN-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide
SMILESCCCNC(=O)CCNC1CCCCC1C1CCCN1
InChIInChI=1S/C16H31N3O/c1-2-10-19-16(20)9-12-18-14-7-4-3-6-13(14)15-8-5-11-17-15/h13-15,17-18H,2-12H2,1H3,(H,19,20)
InChIKeyGNUOSSDFHVPDLT-UHFFFAOYSA-N
XLogP1.80
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]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

N-butan-2-yl-3-[(2-pyrrolidin-2-ylcyclopentyl)amino]propanamide
CID 79544355
N-cyclopropyl-3-[(2-piperidin-2-ylcyclopentyl)amino]propanamide
CID 79545104
N-cyclopropyl-4-[(2-pyrrolidin-2-ylcyclohexyl)amino]butanamide
CID 79536954
ethyl 4-[(2-piperidin-2-ylcyclohexyl)amino]butanoate
CID 79541683
N-hexyl-2-piperidin-2-ylcyclopentan-1-amine
CID 79545809
N-ethyl-2-piperidin-2-ylcyclohexan-1-amine
CID 79553478
N-propyl-3-[[2-(trifluoromethyl)cyclohexyl]amino]propanamide
CID 64756871
5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol
CID 106122125
N-(3-methylsulfanylpropyl)-2-pyrrolidin-2-ylcyclohexan-1-amine
CID 79549363
N-methyl-2-[(2-piperidin-2-ylcyclopentyl)amino]ethanesulfonamide
CID 106333617
2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl carbamate
CID 83210601
3-[(2-piperidin-2-ylcyclopentyl)amino]propan-1-ol
CID 79544914

Frequently Asked Questions

What is the IUPAC name of N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide?
The IUPAC name of N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide (CID 79548705) is N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide.
What is the SMILES notation for N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide?
The canonical SMILES for N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide is CCCNC(=O)CCNC1CCCCC1C1CCCN1.
What is the InChIKey of N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide?
The InChIKey is GNUOSSDFHVPDLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-2-10-19-16(20)9-12-18-14-7-4-3-6-13(14)15-8-5-11-17-15/h13-15,17-18H,2-12H2,1H3,(H,19,20).
What are the key properties of N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide?
N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide has a molecular weight of 281.44 g/mol, XLogP of 1.80, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propanamide is sourced from PubChem (CID 79548705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).