N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide

C14H23NO2 — CID 79208729

IUPACN-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide
SMILESO=C(NCC1CCCC1O)C1C2CCCCC21
InChIInChI=1S/C14H23NO2/c16-12-7-3-4-9(12)8-15-14(17)13-10-5-1-2-6-11(10)13/h9-13,16H,1-8H2,(H,15,17)
InChIKeyXNHRBNGKDKMDIM-UHFFFAOYSA-N
MW237.34 g/mol
LogP1.70
Rot. Bonds3

About N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide

N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide (PubChem CID 79208729) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide.

Molecular Properties

Compound NameN-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide
PubChem CID79208729
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC NameN-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide
SMILESO=C(NCC1CCCC1O)C1C2CCCCC21
InChIInChI=1S/C14H23NO2/c16-12-7-3-4-9(12)8-15-14(17)13-10-5-1-2-6-11(10)13/h9-13,16H,1-8H2,(H,15,17)
InChIKeyXNHRBNGKDKMDIM-UHFFFAOYSA-N
XLogP1.70
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-hydroxycyclohexyl)methyl]cyclopentanecarboxamide
CID 64928899
N-[[2-(chloromethyl)cyclopentyl]methyl]bicyclo[3.1.0]hexane-6-carboxamide
CID 114306831
4-[(2-hydroxycyclohexyl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120673772
N-[(2-hydroxycyclohexyl)methyl]-2,4,5-trimethyloxolane-3-carboxamide
CID 65160273
N-[(2-hydroxycyclopentyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 111463943
N-[(2-hydroxycyclohexyl)methyl]thiolane-3-carboxamide
CID 64911749
N-[(2-hydroxycyclohexyl)methyl]-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 79002982
N-[[(1R,2S)-2-hydroxycyclopentyl]methyl]prop-2-enamide
CID 166414598
4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide
CID 66235488
N-[(2-hydroxycyclohexyl)methyl]oxane-3-carboxamide
CID 64911747
N-[(2-hydroxycyclohexyl)methyl]-4-methylpyrrolidine-3-carboxamide
CID 64912863
N-(piperidin-2-ylmethyl)bicyclo[3.1.0]hexane-6-carboxamide
CID 81479063

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide?
The IUPAC name of N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide (CID 79208729) is N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide.
What is the SMILES notation for N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide?
The canonical SMILES for N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide is O=C(NCC1CCCC1O)C1C2CCCCC21.
What is the InChIKey of N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide?
The InChIKey is XNHRBNGKDKMDIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c16-12-7-3-4-9(12)8-15-14(17)13-10-5-1-2-6-11(10)13/h9-13,16H,1-8H2,(H,15,17).
What are the key properties of N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide?
N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide has a molecular weight of 237.34 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide is sourced from PubChem (CID 79208729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).