N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride

C13H27ClN2 — CID 115597495

IUPACN-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride
SMILESCCN1CCCC(CNC2CCCC2)C1.Cl
InChIInChI=1S/C13H26N2.ClH/c1-2-15-9-5-6-12(11-15)10-14-13-7-3-4-8-13;/h12-14H,2-11H2,1H3;1H
InChIKeyFNSQYNGFSKXQOL-UHFFFAOYSA-N
MW246.83 g/mol
LogP2.67
Rot. Bonds4

About N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride

N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride (PubChem CID 115597495) has the molecular formula C13H27ClN2 and a molecular weight of 246.83 g/mol. Its IUPAC name is N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride.

Molecular Properties

Compound NameN-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride
PubChem CID115597495
Molecular FormulaC13H27ClN2
Molecular Weight246.83 g/mol
Exact Mass246.19
IUPAC NameN-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride
SMILESCCN1CCCC(CNC2CCCC2)C1.Cl
InChIInChI=1S/C13H26N2.ClH/c1-2-15-9-5-6-12(11-15)10-14-13-7-3-4-8-13;/h12-14H,2-11H2,1H3;1H
InChIKeyFNSQYNGFSKXQOL-UHFFFAOYSA-N
XLogP2.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.83
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopentylmethyl)-1-ethylazepan-4-amine
CID 65074491
4-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclohexane-1,4-diamine
CID 79731283
N-[(1-ethylpyrrolidin-3-yl)methyl]oxan-4-amine
CID 60855683
N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine
CID 65365085
N-(cyclobutylmethyl)-1-ethylpiperidin-4-amine
CID 43298506
N-[(1-ethylpiperidin-3-yl)methyl]-1,1,1-trifluoromethanamine
CID 71635317
1-ethyl-N-(thian-4-ylmethyl)azepan-4-amine
CID 113487394
N-[(1-methylpyrrolidin-3-yl)methyl]cyclopentanamine
CID 60856905
N-[[1-[2-(1-methylpiperidin-2-yl)ethyl]piperidin-3-yl]methyl]cyclopropanamine
CID 107912652
2-cyclopentyl-N-[(1-ethylpiperidin-3-yl)methyl]acetamide
CID 75418465
N-[(1-ethylpyrrolidin-3-yl)methyl]pyrrolidin-3-amine
CID 79731365
N-[(1-ethylpiperidin-3-yl)methyl]-2,2,2-trifluoroethanamine
CID 83982976

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride?
The IUPAC name of N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride (CID 115597495) is N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride.
What is the SMILES notation for N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride?
The canonical SMILES for N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride is CCN1CCCC(CNC2CCCC2)C1.Cl.
What is the InChIKey of N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride?
The InChIKey is FNSQYNGFSKXQOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2.ClH/c1-2-15-9-5-6-12(11-15)10-14-13-7-3-4-8-13;/h12-14H,2-11H2,1H3;1H.
What are the key properties of N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride?
N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride has a molecular weight of 246.83 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpiperidin-3-yl)methyl]cyclopentanamine;hydrochloride is sourced from PubChem (CID 115597495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).