2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol

C17H33NO — CID 62609053

IUPAC2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)C(CN(CCC)CC2CC2)C1
InChIInChI=1S/C17H33NO/c1-3-5-14-8-9-17(19)16(11-14)13-18(10-4-2)12-15-6-7-15/h14-17,19H,3-13H2,1-2H3
InChIKeyHINXKQXEZVTJJI-UHFFFAOYSA-N
MW267.46 g/mol
LogP3.69
Rot. Bonds8

About 2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol

2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol (PubChem CID 62609053) has the molecular formula C17H33NO and a molecular weight of 267.46 g/mol. Its IUPAC name is 2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol.

Molecular Properties

Compound Name2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol
PubChem CID62609053
Molecular FormulaC17H33NO
Molecular Weight267.46 g/mol
Exact Mass267.26
IUPAC Name2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)C(CN(CCC)CC2CC2)C1
InChIInChI=1S/C17H33NO/c1-3-5-14-8-9-17(19)16(11-14)13-18(10-4-2)12-15-6-7-15/h14-17,19H,3-13H2,1-2H3
InChIKeyHINXKQXEZVTJJI-UHFFFAOYSA-N
XLogP3.69
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol
CID 62609054
4-ethyl-2-[[2-hydroxyethyl(propyl)amino]methyl]cyclohexan-1-ol
CID 55094394
2-[(2-amino-5-propylcyclohexyl)methyl-propylamino]ethanol
CID 62610160
2-(3-hydroxypropyl)-4-propylcyclohexan-1-ol
CID 79422814
2-(2-methylbutyl)-4-propylcyclohexan-1-ol
CID 63459236
2-[(4-fluoro-N-methylanilino)methyl]-4-propylcyclohexan-1-ol
CID 63488559
2-[[2-(ethylamino)-5-propylcyclohexyl]methyl-propylamino]ethanol
CID 62610162
2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-one
CID 55094828
2-[(N,2-dimethylanilino)methyl]-4-propylcyclohexan-1-ol
CID 63487718
2-[[methyl-(1-methylpiperidin-3-yl)amino]methyl]-4-propylcyclohexan-1-ol
CID 62609589
2-(2-methylpentyl)-4-propylcyclohexan-1-ol
CID 63461803
2-[[(1-ethylpyrrolidin-2-yl)methyl-methylamino]methyl]-4-propylcyclohexan-1-ol
CID 79310538

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol?
The IUPAC name of 2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol (CID 62609053) is 2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol.
What is the SMILES notation for 2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol?
The canonical SMILES for 2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol is CCCC1CCC(O)C(CN(CCC)CC2CC2)C1.
What is the InChIKey of 2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol?
The InChIKey is HINXKQXEZVTJJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO/c1-3-5-14-8-9-17(19)16(11-14)13-18(10-4-2)12-15-6-7-15/h14-17,19H,3-13H2,1-2H3.
What are the key properties of 2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol?
2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol has a molecular weight of 267.46 g/mol, XLogP of 3.69, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclopropylmethyl(propyl)amino]methyl]-4-propylcyclohexan-1-ol is sourced from PubChem (CID 62609053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).