N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine

C18H30N2S — CID 43740557

IUPACN-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine
SMILESCC(C)N1CCC(NC(c2cccs2)C2CCCC2)CC1
InChIInChI=1S/C18H30N2S/c1-14(2)20-11-9-16(10-12-20)19-18(15-6-3-4-7-15)17-8-5-13-21-17/h5,8,13-16,18-19H,3-4,6-7,9-12H2,1-2H3
InChIKeyWYOZZEYMLHQFQV-UHFFFAOYSA-N
MW306.52 g/mol
LogP4.44
Rot. Bonds5

About N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine

N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine (PubChem CID 43740557) has the molecular formula C18H30N2S and a molecular weight of 306.52 g/mol. Its IUPAC name is N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine
PubChem CID43740557
Molecular FormulaC18H30N2S
Molecular Weight306.52 g/mol
Exact Mass306.21
IUPAC NameN-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine
SMILESCC(C)N1CCC(NC(c2cccs2)C2CCCC2)CC1
InChIInChI=1S/C18H30N2S/c1-14(2)20-11-9-16(10-12-20)19-18(15-6-3-4-7-15)17-8-5-13-21-17/h5,8,13-16,18-19H,3-4,6-7,9-12H2,1-2H3
InChIKeyWYOZZEYMLHQFQV-UHFFFAOYSA-N
XLogP4.44
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.52
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclopentyl(thiophen-2-yl)methyl]cyclopropanamine
CID 43754683
1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 43182947
N-[cyclopentyl(thiophen-2-yl)methyl]-1-methylpyrrolidin-3-amine
CID 61462402
N-[(R)-cyclopropyl(thiophen-2-yl)methyl]cyclobutanamine
CID 51921587
N-[cyclopropyl(thiophen-2-yl)methyl]thian-4-amine
CID 115576085
N-[cyclopentyl(thiophen-2-yl)methyl]-5-methylthiolan-3-amine
CID 79942468
N-[cyclopentyl(thiophen-2-yl)methyl]azepan-4-amine
CID 103981438
4-N-[cyclopropyl(thiophen-2-yl)methyl]cyclohexane-1,4-diamine
CID 55062292
1-propan-2-yl-N-(2-thiophen-2-ylpropyl)piperidin-4-amine
CID 75428213
N-[cyclopentyl(thiophen-2-yl)methyl]-3-ethylcyclopentan-1-amine
CID 64502337
N-[cyclopentyl(thiophen-2-yl)methyl]-1-(1-methylpiperidin-4-yl)ethanamine
CID 43740525
N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine
CID 115710812

Frequently Asked Questions

What is the IUPAC name of N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine?
The IUPAC name of N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine (CID 43740557) is N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine.
What is the SMILES notation for N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine?
The canonical SMILES for N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine is CC(C)N1CCC(NC(c2cccs2)C2CCCC2)CC1.
What is the InChIKey of N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine?
The InChIKey is WYOZZEYMLHQFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2S/c1-14(2)20-11-9-16(10-12-20)19-18(15-6-3-4-7-15)17-8-5-13-21-17/h5,8,13-16,18-19H,3-4,6-7,9-12H2,1-2H3.
What are the key properties of N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine?
N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine has a molecular weight of 306.52 g/mol, XLogP of 4.44, 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-propan-2-ylpiperidin-4-amine is sourced from PubChem (CID 43740557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).