2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide

C16H30N2O — CID 119460240

IUPAC2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide
SMILESCCC(CC1CCCC1)C(=O)NCC1CCCNC1
InChIInChI=1S/C16H30N2O/c1-2-15(10-13-6-3-4-7-13)16(19)18-12-14-8-5-9-17-11-14/h13-15,17H,2-12H2,1H3,(H,18,19)
InChIKeyAIKHHWXZCXEDHF-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.71
Rot. Bonds6

About 2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide

2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide (PubChem CID 119460240) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide.

Molecular Properties

Compound Name2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide
PubChem CID119460240
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide
SMILESCCC(CC1CCCC1)C(=O)NCC1CCCNC1
InChIInChI=1S/C16H30N2O/c1-2-15(10-13-6-3-4-7-13)16(19)18-12-14-8-5-9-17-11-14/h13-15,17H,2-12H2,1H3,(H,18,19)
InChIKeyAIKHHWXZCXEDHF-UHFFFAOYSA-N
XLogP2.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-N-(piperidin-3-ylmethyl)butanamide;hydrochloride
CID 119462909
2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride
CID 119555362
2-(cyclopentylmethyl)-N-(pyrrolidin-2-ylmethyl)butanamide
CID 119510207
2-(cyclopentylmethyl)-N-(pyrrolidin-2-ylmethyl)butanamide;hydrochloride
CID 119510206
2-(cyclopentylmethyl)-N-pyrrolidin-3-ylbutanamide
CID 119449890
2-methoxy-N-(piperidin-3-ylmethyl)butanamide
CID 119461438
2-(cyclohexylmethyl)-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119450514
2-amino-N-(piperidin-3-ylmethyl)propanamide;hydrochloride
CID 131134455
1-(piperidin-3-ylmethyl)-3-propan-2-ylurea
CID 43208690
3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)propanamide;hydrochloride
CID 119461546
2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)butanamide
CID 120553439
2,2,3,3-tetramethyl-N-(piperidin-3-ylmethyl)cyclopropane-1-carboxamide
CID 66475790

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide?
The IUPAC name of 2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide (CID 119460240) is 2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide.
What is the SMILES notation for 2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide?
The canonical SMILES for 2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide is CCC(CC1CCCC1)C(=O)NCC1CCCNC1.
What is the InChIKey of 2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide?
The InChIKey is AIKHHWXZCXEDHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-2-15(10-13-6-3-4-7-13)16(19)18-12-14-8-5-9-17-11-14/h13-15,17H,2-12H2,1H3,(H,18,19).
What are the key properties of 2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide?
2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide has a molecular weight of 266.43 g/mol, XLogP of 2.71, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide is sourced from PubChem (CID 119460240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).