1-(ethylaminomethyl)-4-methylcyclohexan-1-ol

C10H21NO — CID 21302977

IUPAC1-(ethylaminomethyl)-4-methylcyclohexan-1-ol
SMILESCCNCC1(O)CCC(C)CC1
InChIInChI=1S/C10H21NO/c1-3-11-8-10(12)6-4-9(2)5-7-10/h9,11-12H,3-8H2,1-2H3
InChIKeyKWHZRCYZOZNKOP-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.54
Rot. Bonds3

About 1-(ethylaminomethyl)-4-methylcyclohexan-1-ol

1-(ethylaminomethyl)-4-methylcyclohexan-1-ol (PubChem CID 21302977) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 1-(ethylaminomethyl)-4-methylcyclohexan-1-ol.

Molecular Properties

Compound Name1-(ethylaminomethyl)-4-methylcyclohexan-1-ol
PubChem CID21302977
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name1-(ethylaminomethyl)-4-methylcyclohexan-1-ol
SMILESCCNCC1(O)CCC(C)CC1
InChIInChI=1S/C10H21NO/c1-3-11-8-10(12)6-4-9(2)5-7-10/h9,11-12H,3-8H2,1-2H3
InChIKeyKWHZRCYZOZNKOP-UHFFFAOYSA-N
XLogP1.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-1-(propylaminomethyl)cyclohexan-1-ol
CID 62775285
4-ethyl-1-(ethylaminomethyl)cyclohexan-1-ol
CID 62773711
1-[(2-chloroprop-2-enylamino)methyl]-4-methylcyclohexan-1-ol
CID 65120996
1-(ethylaminomethyl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol
CID 62773323
1-[(2-methoxyethylamino)methyl]-4-methylcyclohexan-1-ol
CID 62773369
1-[[[(E)-but-2-enyl]amino]methyl]-4-methylcyclohexan-1-ol
CID 107899031
4-methyl-1-[(3-methylbut-3-enylamino)methyl]cyclohexan-1-ol
CID 114472358
4-methyl-1-[(4-methylpentylamino)methyl]cyclohexan-1-ol
CID 79040662
1-[[(3,3-difluorocyclopentyl)methylamino]methyl]-4-methylcyclohexan-1-ol
CID 114223847
4-methyl-1-[(pyrimidin-2-ylmethylamino)methyl]cyclohexan-1-ol
CID 65116294
4-[(1-hydroxy-4-methylcyclohexyl)methylamino]butanoic acid
CID 65115815
1-[(cyclobutylamino)methyl]-4-methylcyclohexan-1-ol
CID 65115377

Frequently Asked Questions

What is the IUPAC name of 1-(ethylaminomethyl)-4-methylcyclohexan-1-ol?
The IUPAC name of 1-(ethylaminomethyl)-4-methylcyclohexan-1-ol (CID 21302977) is 1-(ethylaminomethyl)-4-methylcyclohexan-1-ol.
What is the SMILES notation for 1-(ethylaminomethyl)-4-methylcyclohexan-1-ol?
The canonical SMILES for 1-(ethylaminomethyl)-4-methylcyclohexan-1-ol is CCNCC1(O)CCC(C)CC1.
What is the InChIKey of 1-(ethylaminomethyl)-4-methylcyclohexan-1-ol?
The InChIKey is KWHZRCYZOZNKOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-3-11-8-10(12)6-4-9(2)5-7-10/h9,11-12H,3-8H2,1-2H3.
What are the key properties of 1-(ethylaminomethyl)-4-methylcyclohexan-1-ol?
1-(ethylaminomethyl)-4-methylcyclohexan-1-ol has a molecular weight of 171.28 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylaminomethyl)-4-methylcyclohexan-1-ol is sourced from PubChem (CID 21302977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).