1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol

C14H22N2O — CID 60909596

IUPAC1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol
SMILESCC(NCC1(O)CCCCC1)c1ccccn1
InChIInChI=1S/C14H22N2O/c1-12(13-7-3-6-10-15-13)16-11-14(17)8-4-2-5-9-14/h3,6-7,10,12,16-17H,2,4-5,8-9,11H2,1H3
InChIKeyINRGHAYROMVXSD-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.43
Rot. Bonds4

About 1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol

1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol (PubChem CID 60909596) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol
PubChem CID60909596
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol
SMILESCC(NCC1(O)CCCCC1)c1ccccn1
InChIInChI=1S/C14H22N2O/c1-12(13-7-3-6-10-15-13)16-11-14(17)8-4-2-5-9-14/h3,6-7,10,12,16-17H,2,4-5,8-9,11H2,1H3
InChIKeyINRGHAYROMVXSD-UHFFFAOYSA-N
XLogP2.43
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[[(1R)-1-pyridin-2-ylethyl]amino]methyl]cycloheptan-1-ol
CID 81407673
1-[(1-pyrazin-2-ylethylamino)methyl]cyclobutan-1-ol
CID 115718531
2-[1-[[[(1S)-1-pyridin-2-ylethyl]amino]methyl]cyclopropyl]acetonitrile
CID 81401842
2-[[(1R)-1-pyridin-2-ylethyl]amino]acetonitrile
CID 81407753
1-[[[(1S)-1-pyridin-3-ylethyl]amino]methyl]cyclopentan-1-ol
CID 81405097
N-(cyclohexylmethyl)-1-pyridin-2-ylethanamine
CID 21279072
1-(1-pyridin-2-ylethylamino)propan-2-ol
CID 43499405
N-[(1S)-1-pyridin-2-ylethyl]but-2-yn-1-amine
CID 81402313
3-[[(1R)-1-pyridin-2-ylethyl]amino]propanoic acid
CID 81406743
N-(1-pyridin-2-ylethyl)pent-4-yn-1-amine
CID 115872152
1-(azepan-1-yl)-2-(1-pyridin-2-ylethylamino)ethanone
CID 43396870
1-piperidin-1-yl-2-(1-pyridin-2-ylethylamino)ethanone
CID 43396900

Frequently Asked Questions

What is the IUPAC name of 1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol?
The IUPAC name of 1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol (CID 60909596) is 1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol is CC(NCC1(O)CCCCC1)c1ccccn1.
What is the InChIKey of 1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol?
The InChIKey is INRGHAYROMVXSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-12(13-7-3-6-10-15-13)16-11-14(17)8-4-2-5-9-14/h3,6-7,10,12,16-17H,2,4-5,8-9,11H2,1H3.
What are the key properties of 1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol?
1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol has a molecular weight of 234.34 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol is sourced from PubChem (CID 60909596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).