4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol

C12H18N2O — CID 106130739

IUPAC4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol
SMILESOC1CCC(CNc2ccncc2)CC1
InChIInChI=1S/C12H18N2O/c15-12-3-1-10(2-4-12)9-14-11-5-7-13-8-6-11/h5-8,10,12,15H,1-4,9H2,(H,13,14)
InChIKeyCZBYJRYEPMNLIW-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.04
Rot. Bonds3

About 4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol

4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol (PubChem CID 106130739) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol
PubChem CID106130739
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol
SMILESOC1CCC(CNc2ccncc2)CC1
InChIInChI=1S/C12H18N2O/c15-12-3-1-10(2-4-12)9-14-11-5-7-13-8-6-11/h5-8,10,12,15H,1-4,9H2,(H,13,14)
InChIKeyCZBYJRYEPMNLIW-UHFFFAOYSA-N
XLogP2.04
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(methylamino)cyclohexyl]methyl]pyridin-4-amine
CID 115213590
4-[(4-methylsulfonylanilino)methyl]cyclohexan-1-ol
CID 106130891
N-[(1-methylpyrrolidin-3-yl)methyl]pyridin-4-amine
CID 60857116
N-(cyclopropylmethyl)-4-pyrimidin-4-ylaniline
CID 141092448
4-[[(6-aminopyrazin-2-yl)amino]methyl]cyclohexan-1-ol
CID 106137920
4-[[(5-chloropyrimidin-2-yl)amino]methyl]cyclohexan-1-ol
CID 106130672
N-[[4-(anilinomethyl)cyclohexyl]methyl]aniline;ethane;methanol
CID 143136691
3-[[[2-(methylamino)-4-pyridinyl]amino]methyl]cyclopentan-1-ol
CID 106138027
1-cyclopropyl-N-(pyridin-4-ylmethyl)methanamine;hydrochloride
CID 167733766
N-[(2-cyclopropylcyclopropyl)methyl]pyridin-4-amine
CID 131084058
N-[(2-aminocyclohexyl)methyl]pyridin-4-amine
CID 64926899
2-cyclohexyl-2-[4-[(pyridin-4-ylamino)methyl]piperidin-1-yl]acetic acid
CID 67642158

Frequently Asked Questions

What is the IUPAC name of 4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol?
The IUPAC name of 4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol (CID 106130739) is 4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol?
The canonical SMILES for 4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol is OC1CCC(CNc2ccncc2)CC1.
What is the InChIKey of 4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol?
The InChIKey is CZBYJRYEPMNLIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c15-12-3-1-10(2-4-12)9-14-11-5-7-13-8-6-11/h5-8,10,12,15H,1-4,9H2,(H,13,14).
What are the key properties of 4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol?
4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol has a molecular weight of 206.29 g/mol, XLogP of 2.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol is sourced from PubChem (CID 106130739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).