(2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol

C14H23N3O — CID 79066724

IUPAC(2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol
SMILESCN(C)C1(C(O)c2cccnc2N)CCCCC1
InChIInChI=1S/C14H23N3O/c1-17(2)14(8-4-3-5-9-14)12(18)11-7-6-10-16-13(11)15/h6-7,10,12,18H,3-5,8-9H2,1-2H3,(H2,15,16)
InChIKeyTVVSHIZTVSDJOT-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.96
Rot. Bonds3

About (2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol

(2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol (PubChem CID 79066724) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is (2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name(2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol
PubChem CID79066724
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name(2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol
SMILESCN(C)C1(C(O)c2cccnc2N)CCCCC1
InChIInChI=1S/C14H23N3O/c1-17(2)14(8-4-3-5-9-14)12(18)11-7-6-10-16-13(11)15/h6-7,10,12,18H,3-5,8-9H2,1-2H3,(H2,15,16)
InChIKeyTVVSHIZTVSDJOT-UHFFFAOYSA-N
XLogP1.96
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[1-(diethylamino)cyclopentyl]-(methylamino)methyl]pyridin-2-amine
CID 79070427
[1-(dimethylamino)cyclopentyl]-(2-ethoxyphenyl)methanol
CID 79067542
[1-(dimethylamino)cyclohexyl]-pyrazin-2-ylmethanol
CID 79066867
(2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanone
CID 79066637
(2-amino-3-pyridinyl)-[1-(dimethylamino)cycloheptyl]methanone
CID 79074262
(1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol
CID 130961552
(2-amino-3-pyridinyl)-(1-ethoxy-3-methylcyclohexyl)methanol
CID 116755162
[1-(dimethylamino)cycloheptyl]-(4-methylphenyl)methanol
CID 79075014
1-[1-(dimethylamino)cyclopentyl]-2-pyridin-2-ylethanol
CID 79067775
1-(2-amino-3-pyridinyl)-2-(dimethylamino)-2-ethylbutan-1-ol
CID 79062350
[1-(dimethylamino)cycloheptyl]-(2-methoxy-5-methylphenyl)methanol
CID 79063099
1-[amino-(2-methylphenyl)methyl]-N,N-dimethylcyclohexan-1-amine
CID 79066805

Frequently Asked Questions

What is the IUPAC name of (2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol?
The IUPAC name of (2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol (CID 79066724) is (2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol.
What is the SMILES notation for (2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol?
The canonical SMILES for (2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol is CN(C)C1(C(O)c2cccnc2N)CCCCC1.
What is the InChIKey of (2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol?
The InChIKey is TVVSHIZTVSDJOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-17(2)14(8-4-3-5-9-14)12(18)11-7-6-10-16-13(11)15/h6-7,10,12,18H,3-5,8-9H2,1-2H3,(H2,15,16).
What are the key properties of (2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol?
(2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol has a molecular weight of 249.36 g/mol, XLogP of 1.96, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-3-pyridinyl)-[1-(dimethylamino)cyclohexyl]methanol is sourced from PubChem (CID 79066724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).