2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine

C14H29N3 — CID 19845944

IUPAC2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine
SMILESNCCN1CCCCC1CNCC1CCCC1
InChIInChI=1S/C14H29N3/c15-8-10-17-9-4-3-7-14(17)12-16-11-13-5-1-2-6-13/h13-14,16H,1-12,15H2
InChIKeyAKVHZQMEAXTFJW-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.58
Rot. Bonds6

About 2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine

2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine (PubChem CID 19845944) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is 2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine
PubChem CID19845944
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC Name2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine
SMILESNCCN1CCCCC1CNCC1CCCC1
InChIInChI=1S/C14H29N3/c15-8-10-17-9-4-3-7-14(17)12-16-11-13-5-1-2-6-13/h13-14,16H,1-12,15H2
InChIKeyAKVHZQMEAXTFJW-UHFFFAOYSA-N
XLogP1.58
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(2-aminoethyl)piperidin-2-yl]methyl]pentan-3-amine
CID 19845975
2-[2-[(cyclopropylmethylamino)methyl]piperidin-1-yl]acetic acid
CID 121230281
N-[[1-(2-fluoroethyl)piperidin-2-yl]methyl]-2-methylpropan-1-amine
CID 80693920
benzyl N-[[(2R)-1-(2-aminoethyl)piperidin-2-yl]methyl]carbamate
CID 96553890
3-amino-N-[[1-(2-cyclohexylethyl)piperidin-2-yl]methyl]propanamide;hydrochloride
CID 120581306
N-[[(2R)-1-propylpiperidin-2-yl]methyl]propan-1-amine
CID 97017290
2-methyl-N-[(1-propylpiperidin-2-yl)methyl]propan-1-amine
CID 62580066
[(2S)-1-(2-cyclohexylethyl)piperidin-2-yl]methanamine
CID 97052114
N-[[1-(2-methoxyethyl)piperidin-2-yl]methyl]propan-1-amine
CID 62580938
2-methyl-N-[[1-(3-pyrrolidin-1-ylpropyl)piperidin-2-yl]methyl]propan-1-amine
CID 62579879
N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-2-yl]methyl]ethanamine
CID 112589848
N-[(1-ethylpyrrolidin-2-yl)methyl]-1-piperidin-4-ylmethanamine
CID 79699728

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine?
The IUPAC name of 2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine (CID 19845944) is 2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine.
What is the SMILES notation for 2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine?
The canonical SMILES for 2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine is NCCN1CCCCC1CNCC1CCCC1.
What is the InChIKey of 2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine?
The InChIKey is AKVHZQMEAXTFJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c15-8-10-17-9-4-3-7-14(17)12-16-11-13-5-1-2-6-13/h13-14,16H,1-12,15H2.
What are the key properties of 2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine?
2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine has a molecular weight of 239.41 g/mol, XLogP of 1.58, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(cyclopentylmethylamino)methyl]piperidin-1-yl]ethanamine is sourced from PubChem (CID 19845944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).