[1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol

C13H25NO — CID 61056029

IUPAC[1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol
SMILESCCC1CCC(CO)(NCC2CC2)CC1
InChIInChI=1S/C13H25NO/c1-2-11-5-7-13(10-15,8-6-11)14-9-12-3-4-12/h11-12,14-15H,2-10H2,1H3
InChIKeyKOHFGCQHBFWTHD-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.32
Rot. Bonds5

About [1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol

[1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol (PubChem CID 61056029) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is [1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol.

Molecular Properties

Compound Name[1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol
PubChem CID61056029
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name[1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol
SMILESCCC1CCC(CO)(NCC2CC2)CC1
InChIInChI=1S/C13H25NO/c1-2-11-5-7-13(10-15,8-6-11)14-9-12-3-4-12/h11-12,14-15H,2-10H2,1H3
InChIKeyKOHFGCQHBFWTHD-UHFFFAOYSA-N
XLogP2.32
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclopropylmethylamino)-4-ethylcyclohexane-1-carboxylic acid
CID 61001600
[1-(cyclobutylmethylamino)cyclohexyl]methanol
CID 65459866
[4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol
CID 79708030
[3-(cyclopropylmethylamino)oxolan-3-yl]methanol
CID 63333038
[4-(cyclobutylmethylamino)oxan-4-yl]methanol
CID 103713933
[4-(cyclooctylmethylamino)oxan-4-yl]methanol
CID 114207828
[1-(benzylamino)-3-ethylcyclopentyl]methanol
CID 64515749
(1-amino-4-ethylcyclohexyl)methanol
CID 61055822
1-(cyclopropylmethoxy)-3-[[1-(hydroxymethyl)-4-methylcyclohexyl]amino]propan-2-ol
CID 62551135
1-[(4-ethylcyclohexyl)methyl]-3-[[1-(hydroxymethyl)cyclopropyl]methyl]urea
CID 111618683
[1-(oxan-3-ylmethylamino)cyclopropyl]methanol
CID 115909437
1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide
CID 54880967

Frequently Asked Questions

What is the IUPAC name of [1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol?
The IUPAC name of [1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol (CID 61056029) is [1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol.
What is the SMILES notation for [1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol?
The canonical SMILES for [1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol is CCC1CCC(CO)(NCC2CC2)CC1.
What is the InChIKey of [1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol?
The InChIKey is KOHFGCQHBFWTHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-2-11-5-7-13(10-15,8-6-11)14-9-12-3-4-12/h11-12,14-15H,2-10H2,1H3.
What are the key properties of [1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol?
[1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol has a molecular weight of 211.35 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol is sourced from PubChem (CID 61056029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).