N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide

C14H20N2O2 — CID 115277422

IUPACN-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide
SMILESCN(C(=O)Cc1cccnc1)C1CCC(O)CC1
InChIInChI=1S/C14H20N2O2/c1-16(12-4-6-13(17)7-5-12)14(18)9-11-3-2-8-15-10-11/h2-3,8,10,12-13,17H,4-7,9H2,1H3
InChIKeyNLMKDGALRQCPGQ-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.39
Rot. Bonds3

About N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide

N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide (PubChem CID 115277422) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide
PubChem CID115277422
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide
SMILESCN(C(=O)Cc1cccnc1)C1CCC(O)CC1
InChIInChI=1S/C14H20N2O2/c1-16(12-4-6-13(17)7-5-12)14(18)9-11-3-2-8-15-10-11/h2-3,8,10,12-13,17H,4-7,9H2,1H3
InChIKeyNLMKDGALRQCPGQ-UHFFFAOYSA-N
XLogP1.39
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-hydroxycyclohexyl)-N-methyl-3-pyridin-3-ylpropanamide
CID 115277440
N-[(1R,2R,3R)-2,3-dihydroxycycloheptyl]-N-methyl-2-pyridin-3-ylacetamide
CID 110125869
N-[(3R,4R)-4-hydroxypyrrolidin-3-yl]-N-methyl-2-pyridin-3-ylacetamide
CID 62691246
N-methyl-2-pyridin-3-ylacetohydrazide
CID 116844877
N-(4-hydroxycyclohexyl)-N-methyl-2-(1H-pyrrol-3-yl)acetamide
CID 115277419
N-methyl-2-pyridin-3-yl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 96575672
N-methyl-N-(piperidin-4-ylmethyl)-2-pyridin-3-ylacetamide
CID 79715380
N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide
CID 79121383
4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol
CID 115239951
1-cyclopropyl-1-methyl-2-(pyridin-3-ylmethyl)guanidine
CID 110029384
N-ethyl-N-iodo-2-pyridin-3-ylacetamide
CID 143532975
N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide
CID 91760229

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide (CID 115277422) is N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide is CN(C(=O)Cc1cccnc1)C1CCC(O)CC1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide?
The InChIKey is NLMKDGALRQCPGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-16(12-4-6-13(17)7-5-12)14(18)9-11-3-2-8-15-10-11/h2-3,8,10,12-13,17H,4-7,9H2,1H3.
What are the key properties of N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide?
N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide has a molecular weight of 248.33 g/mol, XLogP of 1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide is sourced from PubChem (CID 115277422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).