N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine

C18H35N3 — CID 63009402

IUPACN-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine
SMILESCC(CNC1CCCC1)N1CCC(CN2CCCC2)CC1
InChIInChI=1S/C18H35N3/c1-16(14-19-18-6-2-3-7-18)21-12-8-17(9-13-21)15-20-10-4-5-11-20/h16-19H,2-15H2,1H3
InChIKeyOTFOIXHVJMBPAL-UHFFFAOYSA-N
MW293.50 g/mol
LogP2.71
Rot. Bonds6

About N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine

N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine (PubChem CID 63009402) has the molecular formula C18H35N3 and a molecular weight of 293.50 g/mol. Its IUPAC name is N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine.

Molecular Properties

Compound NameN-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine
PubChem CID63009402
Molecular FormulaC18H35N3
Molecular Weight293.50 g/mol
Exact Mass293.28
IUPAC NameN-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine
SMILESCC(CNC1CCCC1)N1CCC(CN2CCCC2)CC1
InChIInChI=1S/C18H35N3/c1-16(14-19-18-6-2-3-7-18)21-12-8-17(9-13-21)15-20-10-4-5-11-20/h16-19H,2-15H2,1H3
InChIKeyOTFOIXHVJMBPAL-UHFFFAOYSA-N
XLogP2.71
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.50
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(azocan-1-yl)propyl]cyclopentanamine
CID 62558696
N-(2-piperidin-1-ylpropyl)cyclopropanamine
CID 62424338
N-[2-(4-ethylpiperidin-1-yl)propyl]cyclopropanamine
CID 62413434
N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine
CID 62557293
N-prop-2-enyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-amine
CID 63009405
N-(2-methoxyethyl)-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-amine
CID 63009404
N-[2-(4-methylpiperazin-1-yl)propyl]cyclohexanamine
CID 62557467
4-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]pentan-2-ol
CID 64720827
N-[2-(4-methylazepan-1-yl)propyl]cyclohexanamine
CID 63627376
N-propan-2-yl-3-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]butan-1-amine
CID 63007603
N-[2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propyl]cyclopentanamine
CID 63167834
N-(3-methoxypropyl)-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-amine
CID 63007462

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine?
The IUPAC name of N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine (CID 63009402) is N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine.
What is the SMILES notation for N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine?
The canonical SMILES for N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine is CC(CNC1CCCC1)N1CCC(CN2CCCC2)CC1.
What is the InChIKey of N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine?
The InChIKey is OTFOIXHVJMBPAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N3/c1-16(14-19-18-6-2-3-7-18)21-12-8-17(9-13-21)15-20-10-4-5-11-20/h16-19H,2-15H2,1H3.
What are the key properties of N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine?
N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine has a molecular weight of 293.50 g/mol, XLogP of 2.71, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine is sourced from PubChem (CID 63009402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).