N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine

C18H28N2S — CID 115710812

IUPACN-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine
SMILESCC1CC(NC(c2cccs2)C2CCCC2)CN1C1CC1
InChIInChI=1S/C18H28N2S/c1-13-11-15(12-20(13)16-8-9-16)19-18(14-5-2-3-6-14)17-7-4-10-21-17/h4,7,10,13-16,18-19H,2-3,5-6,8-9,11-12H2,1H3
InChIKeySLAUEWIKJAQSLB-UHFFFAOYSA-N
MW304.50 g/mol
LogP4.19
Rot. Bonds5

About N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine

N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine (PubChem CID 115710812) has the molecular formula C18H28N2S and a molecular weight of 304.50 g/mol. Its IUPAC name is N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine
PubChem CID115710812
Molecular FormulaC18H28N2S
Molecular Weight304.50 g/mol
Exact Mass304.20
IUPAC NameN-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine
SMILESCC1CC(NC(c2cccs2)C2CCCC2)CN1C1CC1
InChIInChI=1S/C18H28N2S/c1-13-11-15(12-20(13)16-8-9-16)19-18(14-5-2-3-6-14)17-7-4-10-21-17/h4,7,10,13-16,18-19H,2-3,5-6,8-9,11-12H2,1H3
InChIKeySLAUEWIKJAQSLB-UHFFFAOYSA-N
XLogP4.19
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.50
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine
CID 113491658
1-cyclopropyl-5-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine
CID 115713136
N-[cyclopentyl(thiophen-2-yl)methyl]-5-methylthiolan-3-amine
CID 79942468
N-[cyclopentyl(thiophen-2-yl)methyl]cyclopropanamine
CID 43754683
N-[cyclopentyl(thiophen-2-yl)methyl]-1-methylpyrrolidin-3-amine
CID 61462402
N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine
CID 43740557
N-[(R)-cyclopropyl(thiophen-2-yl)methyl]cyclobutanamine
CID 51921587
N-[cyclopentyl(thiophen-2-yl)methyl]-3-ethylcyclopentan-1-amine
CID 64502337
N-[cyclopropyl(thiophen-2-yl)methyl]thian-4-amine
CID 115576085
N-[cyclopentyl(thiophen-2-yl)methyl]azepan-4-amine
CID 103981438
N-[cyclopropyl(thiophen-2-yl)methyl]-3-methylsulfanylcyclohexan-1-amine
CID 113350069
[cyclooctyl(thiophen-2-yl)methyl]hydrazine
CID 105255061

Frequently Asked Questions

What is the IUPAC name of N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine?
The IUPAC name of N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine (CID 115710812) is N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine.
What is the SMILES notation for N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine?
The canonical SMILES for N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine is CC1CC(NC(c2cccs2)C2CCCC2)CN1C1CC1.
What is the InChIKey of N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine?
The InChIKey is SLAUEWIKJAQSLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2S/c1-13-11-15(12-20(13)16-8-9-16)19-18(14-5-2-3-6-14)17-7-4-10-21-17/h4,7,10,13-16,18-19H,2-3,5-6,8-9,11-12H2,1H3.
What are the key properties of N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine?
N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine has a molecular weight of 304.50 g/mol, XLogP of 4.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine is sourced from PubChem (CID 115710812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).