N-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide

C15H22N2O2 — CID 115277500

IUPACN-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide
SMILESO=C(CCCc1cccnc1)NC1CCC(O)CC1
InChIInChI=1S/C15H22N2O2/c18-14-8-6-13(7-9-14)17-15(19)5-1-3-12-4-2-10-16-11-12/h2,4,10-11,13-14,18H,1,3,5-9H2,(H,17,19)
InChIKeySXNPYPGYFUVLGD-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.82
Rot. Bonds5

About N-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide

N-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide (PubChem CID 115277500) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide
PubChem CID115277500
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide
SMILESO=C(CCCc1cccnc1)NC1CCC(O)CC1
InChIInChI=1S/C15H22N2O2/c18-14-8-6-13(7-9-14)17-15(19)5-1-3-12-4-2-10-16-11-12/h2,4,10-11,13-14,18H,1,3,5-9H2,(H,17,19)
InChIKeySXNPYPGYFUVLGD-UHFFFAOYSA-N
XLogP1.82
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2-pyridin-3-ylacetyl)amino]cyclohexane-1-carboxylic acid
CID 62689674
N-[4-(cyclopropylcarbamoylamino)phenyl]-3-pyridin-3-ylpropanamide
CID 37294420
ethyl 4-(3-pyridin-3-ylpropanoylamino)piperidine-1-carboxylate
CID 31369357
N-(4-hydroxycyclohexyl)-2-pyridin-4-ylacetamide
CID 43508886
N-(2-methylprop-1-enyl)-3-pyridin-3-ylpropanamide
CID 177435209
N-[4-(2-hydroxyethyl)cyclohexyl]-2-pyridin-3-ylacetamide
CID 116817232
N-cyclopropyl-2-[4-[(2-pyridin-3-ylacetyl)amino]phenyl]acetamide
CID 131905029
N-[(3R,3aR,6R,6aR)-6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]-3-pyridin-3-ylpropanamide
CID 154822153
N-[1-(morpholine-4-carbonyl)piperidin-4-yl]-3-pyridin-3-ylpropanamide
CID 77081879
N-(2-phenylethyl)-4-pyridin-3-ylbutanamide
CID 110410890
N-[1-(1,1-dioxothian-4-yl)piperidin-4-yl]-3-pyridin-3-ylpropanamide
CID 91773911
3-[(2-pyridin-3-ylacetyl)amino]cyclopentane-1-carboxylic acid
CID 66032903

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide (CID 115277500) is N-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide is O=C(CCCc1cccnc1)NC1CCC(O)CC1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide?
The InChIKey is SXNPYPGYFUVLGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c18-14-8-6-13(7-9-14)17-15(19)5-1-3-12-4-2-10-16-11-12/h2,4,10-11,13-14,18H,1,3,5-9H2,(H,17,19).
What are the key properties of N-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide?
N-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide has a molecular weight of 262.35 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-4-pyridin-3-ylbutanamide is sourced from PubChem (CID 115277500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).