2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol

C14H27NO — CID 106506751

IUPAC2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol
SMILESNCC(CO)(CC1CCCCC1)CC1CC1
InChIInChI=1S/C14H27NO/c15-10-14(11-16,9-13-6-7-13)8-12-4-2-1-3-5-12/h12-13,16H,1-11,15H2
InChIKeyOMFIBJHOZMMLMJ-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.69
Rot. Bonds6

About 2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol

2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol (PubChem CID 106506751) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol.

Molecular Properties

Compound Name2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol
PubChem CID106506751
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol
SMILESNCC(CO)(CC1CCCCC1)CC1CC1
InChIInChI=1S/C14H27NO/c15-10-14(11-16,9-13-6-7-13)8-12-4-2-1-3-5-12/h12-13,16H,1-11,15H2
InChIKeyOMFIBJHOZMMLMJ-UHFFFAOYSA-N
XLogP2.69
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 66058711
2-(cyclopentylmethyl)-2-ethylpropane-1,3-diol
CID 79449950
3-cycloheptyl-2,2-difluoropropan-1-ol
CID 105446100
2-(aminomethyl)-3-cyclobutyl-2-methylpropan-1-ol
CID 84716654
2-(aminomethyl)-2-(cyclopropylmethyl)-4-propylsulfonylbutan-1-ol
CID 106730792
2-(aminomethyl)-3-cycloheptyl-1,1,1-trifluoropropan-2-ol
CID 115043071
2-(aminomethyl)-2-(cyclopropylmethyl)-4-(1-methylimidazol-2-yl)butan-1-ol
CID 106506866
2-amino-3-cyclobutyl-2-(cyclobutylmethyl)propan-1-ol
CID 144726385
3-cyclohexyl-2-cyclopropyl-2-methylpropan-1-amine
CID 83149608
2-(aminomethyl)-3-cyclopentyl-1,1,1-trifluoropropan-2-ol
CID 115027287
3-cyclopentyl-2,2-dimethylpropan-1-amine;hydrochloride
CID 122240185
2-amino-1-cyclohexylpropan-2-ol
CID 57094409

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol?
The IUPAC name of 2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol (CID 106506751) is 2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol.
What is the SMILES notation for 2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol?
The canonical SMILES for 2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol is NCC(CO)(CC1CCCCC1)CC1CC1.
What is the InChIKey of 2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol?
The InChIKey is OMFIBJHOZMMLMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c15-10-14(11-16,9-13-6-7-13)8-12-4-2-1-3-5-12/h12-13,16H,1-11,15H2.
What are the key properties of 2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol?
2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol has a molecular weight of 225.38 g/mol, XLogP of 2.69, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-2-(cyclohexylmethyl)-3-cyclopropylpropan-1-ol is sourced from PubChem (CID 106506751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).