1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol

C15H25N3O — CID 117039421

IUPAC1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol
SMILESCN(CCc1ccccn1)C1CCC(O)(CN)CC1
InChIInChI=1S/C15H25N3O/c1-18(11-7-13-4-2-3-10-17-13)14-5-8-15(19,12-16)9-6-14/h2-4,10,14,19H,5-9,11-12,16H2,1H3
InChIKeyJFLAITWNZLAWAI-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.19
Rot. Bonds5

About 1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol

1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol (PubChem CID 117039421) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol
PubChem CID117039421
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol
SMILESCN(CCc1ccccn1)C1CCC(O)(CN)CC1
InChIInChI=1S/C15H25N3O/c1-18(11-7-13-4-2-3-10-17-13)14-5-8-15(19,12-16)9-6-14/h2-4,10,14,19H,5-9,11-12,16H2,1H3
InChIKeyJFLAITWNZLAWAI-UHFFFAOYSA-N
XLogP1.19
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-N-methyl-1-N-(2-pyridin-2-ylethyl)cyclopentane-1,2-diamine
CID 43211466
1-[[methyl(2-pyridin-2-ylethyl)amino]methyl]cyclopentan-1-ol
CID 65212670
(2R)-N-methyl-N-(2-pyridin-2-ylethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 26458421
4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]piperidin-4-ol
CID 55048388
3-(aminomethyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)thian-3-amine
CID 79957696
1-(aminomethyl)-4-[methyl(pentyl)amino]cyclohexan-1-ol
CID 117039414
N-[[1-(2-aminoethyl)cyclopropyl]methyl]-N-methyl-2-pyridin-2-ylethanamine
CID 65479518
2,2-dimethyl-5-[[methyl(2-pyridin-2-ylethyl)amino]methyl]cyclopentan-1-ol
CID 79856114
N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide
CID 63175508
2-methyl-2-[[methyl(2-pyridin-2-ylethyl)amino]methyl]cyclopentan-1-amine
CID 82768381
N-methyl-N-(2-pyridin-2-ylethyl)prop-1-en-2-amine
CID 178172839
3-(aminomethyl)-N-methyl-N-(2-pyridin-2-ylethyl)oxetane-3-carboxamide
CID 115185783

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol?
The IUPAC name of 1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol (CID 117039421) is 1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol.
What is the SMILES notation for 1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol?
The canonical SMILES for 1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol is CN(CCc1ccccn1)C1CCC(O)(CN)CC1.
What is the InChIKey of 1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol?
The InChIKey is JFLAITWNZLAWAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-18(11-7-13-4-2-3-10-17-13)14-5-8-15(19,12-16)9-6-14/h2-4,10,14,19H,5-9,11-12,16H2,1H3.
What are the key properties of 1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol?
1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol has a molecular weight of 263.38 g/mol, XLogP of 1.19, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol is sourced from PubChem (CID 117039421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).