1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide

C14H27N3O — CID 61241468

IUPAC1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide
SMILESCC1CCN(CCNC(=O)C2(N)CCCC2)CC1
InChIInChI=1S/C14H27N3O/c1-12-4-9-17(10-5-12)11-8-16-13(18)14(15)6-2-3-7-14/h12H,2-11,15H2,1H3,(H,16,18)
InChIKeyIUAPSJSMPJGFAA-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.11
Rot. Bonds4

About 1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide

1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide (PubChem CID 61241468) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide
PubChem CID61241468
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide
SMILESCC1CCN(CCNC(=O)C2(N)CCCC2)CC1
InChIInChI=1S/C14H27N3O/c1-12-4-9-17(10-5-12)11-8-16-13(18)14(15)6-2-3-7-14/h12H,2-11,15H2,1H3,(H,16,18)
InChIKeyIUAPSJSMPJGFAA-UHFFFAOYSA-N
XLogP1.11
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide (CID 61241468) is 1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide is CC1CCN(CCNC(=O)C2(N)CCCC2)CC1.
What is the InChIKey of 1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is IUAPSJSMPJGFAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-12-4-9-17(10-5-12)11-8-16-13(18)14(15)6-2-3-7-14/h12H,2-11,15H2,1H3,(H,16,18).
What are the key properties of 1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide?
1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 61241468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).