N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine

C21H32N2 — CID 57083287

IUPACN-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine
SMILESCCCN(CC1CC1)C1CCC2=c3c(ccn3CCC)=CCC21
InChIInChI=1S/C21H32N2/c1-3-12-22-14-11-17-7-8-18-19(21(17)22)9-10-20(18)23(13-4-2)15-16-5-6-16/h7,11,14,16,18,20H,3-6,8-10,12-13,15H2,1-2H3
InChIKeySCOQASUESGKXAQ-UHFFFAOYSA-N
MW312.50 g/mol
LogP3.13
Rot. Bonds7

About N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine

N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine (PubChem CID 57083287) has the molecular formula C21H32N2 and a molecular weight of 312.50 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine
PubChem CID57083287
Molecular FormulaC21H32N2
Molecular Weight312.50 g/mol
Exact Mass312.26
IUPAC NameN-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine
SMILESCCCN(CC1CC1)C1CCC2=c3c(ccn3CCC)=CCC21
InChIInChI=1S/C21H32N2/c1-3-12-22-14-11-17-7-8-18-19(21(17)22)9-10-20(18)23(13-4-2)15-16-5-6-16/h7,11,14,16,18,20H,3-6,8-10,12-13,15H2,1-2H3
InChIKeySCOQASUESGKXAQ-UHFFFAOYSA-N
XLogP3.13
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.50
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine?
The IUPAC name of N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine (CID 57083287) is N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine?
The canonical SMILES for N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine is CCCN(CC1CC1)C1CCC2=c3c(ccn3CCC)=CCC21.
What is the InChIKey of N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine?
The InChIKey is SCOQASUESGKXAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H32N2/c1-3-12-22-14-11-17-7-8-18-19(21(17)22)9-10-20(18)23(13-4-2)15-16-5-6-16/h7,11,14,16,18,20H,3-6,8-10,12-13,15H2,1-2H3.
What are the key properties of N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine?
N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine has a molecular weight of 312.50 g/mol, XLogP of 3.13, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N,1-dipropyl-5a,6,7,8-tetrahydro-5H-cyclopenta[g]indol-6-amine is sourced from PubChem (CID 57083287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).