N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine

C17H35N3 — CID 62261471

IUPACN-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine
SMILESCCCN1CCN(CC(CC)(CC)CNC2CC2)CC1
InChIInChI=1S/C17H35N3/c1-4-9-19-10-12-20(13-11-19)15-17(5-2,6-3)14-18-16-7-8-16/h16,18H,4-15H2,1-3H3
InChIKeyLPBMUDUVNNUURW-UHFFFAOYSA-N
MW281.49 g/mol
LogP2.57
Rot. Bonds9

About N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine

N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine (PubChem CID 62261471) has the molecular formula C17H35N3 and a molecular weight of 281.49 g/mol. Its IUPAC name is N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine
PubChem CID62261471
Molecular FormulaC17H35N3
Molecular Weight281.49 g/mol
Exact Mass281.28
IUPAC NameN-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine
SMILESCCCN1CCN(CC(CC)(CC)CNC2CC2)CC1
InChIInChI=1S/C17H35N3/c1-4-9-19-10-12-20(13-11-19)15-17(5-2,6-3)14-18-16-7-8-16/h16,18H,4-15H2,1-3H3
InChIKeyLPBMUDUVNNUURW-UHFFFAOYSA-N
XLogP2.57
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.49
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine 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-[4-[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-1,4-diazepan-1-yl]ethanol
CID 107226446
N-[2-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)butyl]cyclopropanamine
CID 66371193
1-[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-4-methylazepan-4-ol
CID 107408778
N-[2-[(3-ethoxypiperidin-1-yl)methyl]-2-ethylbutyl]cyclopropanamine
CID 62270798
N-[4-(4-propylpiperazin-1-yl)butyl]cyclopropanamine
CID 62424326
2-[1-[2-[(cyclopropylamino)methyl]-2-ethylbutyl]piperidin-3-yl]ethanol
CID 107228852
N'-cyclopropyl-2,2-diethylpropane-1,3-diamine
CID 115432791
N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine
CID 83221375
2-[(4-cyclopropylpiperazin-1-yl)methyl]-2-ethyl-N-propylbutan-1-amine
CID 62272448
N-[2,2-dimethyl-3-(4-propylpiperidin-1-yl)propyl]cyclopropanamine
CID 62257753
2-[(4-cyclopropylpiperazin-1-yl)methyl]-N,2-diethylbutan-1-amine
CID 55056218
N-cyclopropyl-2,2-diethyl-N'-methyl-N'-[(1-methylpiperidin-4-yl)methyl]propane-1,3-diamine
CID 63234674

Frequently Asked Questions

What is the IUPAC name of N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine?
The IUPAC name of N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine (CID 62261471) is N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine.
What is the SMILES notation for N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine?
The canonical SMILES for N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine is CCCN1CCN(CC(CC)(CC)CNC2CC2)CC1.
What is the InChIKey of N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine?
The InChIKey is LPBMUDUVNNUURW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N3/c1-4-9-19-10-12-20(13-11-19)15-17(5-2,6-3)14-18-16-7-8-16/h16,18H,4-15H2,1-3H3.
What are the key properties of N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine?
N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine has a molecular weight of 281.49 g/mol, XLogP of 2.57, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine is sourced from PubChem (CID 62261471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).