N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine

C14H29N3 — CID 115230585

IUPACN-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine
SMILESCN(CCCN1CCNCC1)CC1CCCC1
InChIInChI=1S/C14H29N3/c1-16(13-14-5-2-3-6-14)9-4-10-17-11-7-15-8-12-17/h14-15H,2-13H2,1H3
InChIKeyDPHPPDUWRHGRSX-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.40
Rot. Bonds6

About N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine

N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine (PubChem CID 115230585) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine
PubChem CID115230585
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC NameN-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine
SMILESCN(CCCN1CCNCC1)CC1CCCC1
InChIInChI=1S/C14H29N3/c1-16(13-14-5-2-3-6-14)9-4-10-17-11-7-15-8-12-17/h14-15H,2-13H2,1H3
InChIKeyDPHPPDUWRHGRSX-UHFFFAOYSA-N
XLogP1.40
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine?
The IUPAC name of N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine (CID 115230585) is N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine.
What is the SMILES notation for N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine?
The canonical SMILES for N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine is CN(CCCN1CCNCC1)CC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine?
The InChIKey is DPHPPDUWRHGRSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-16(13-14-5-2-3-6-14)9-4-10-17-11-7-15-8-12-17/h14-15H,2-13H2,1H3.
What are the key properties of N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine?
N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine has a molecular weight of 239.41 g/mol, XLogP of 1.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine is sourced from PubChem (CID 115230585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).