3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol

C15H32N2O — CID 64826426

IUPAC3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
SMILESCCCNC(C)(CO)CN(C)CC1CCCCC1
InChIInChI=1S/C15H32N2O/c1-4-10-16-15(2,13-18)12-17(3)11-14-8-6-5-7-9-14/h14,16,18H,4-13H2,1-3H3
InChIKeyOPLVVKYWDLZSCV-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.25
Rot. Bonds8

About 3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol

3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol (PubChem CID 64826426) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol.

Molecular Properties

Compound Name3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
PubChem CID64826426
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
SMILESCCCNC(C)(CO)CN(C)CC1CCCCC1
InChIInChI=1S/C15H32N2O/c1-4-10-16-15(2,13-18)12-17(3)11-14-8-6-5-7-9-14/h14,16,18H,4-13H2,1-3H3
InChIKeyOPLVVKYWDLZSCV-UHFFFAOYSA-N
XLogP2.25
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[cyclopropylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64825469
3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol
CID 64786271
3-[cyclopentylmethyl(methyl)amino]-2-(cyclopropylamino)-2-methylpropan-1-ol
CID 64787635
5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol
CID 64787636
2-(ethylamino)-2-methyl-3-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]propan-1-ol
CID 64791463
1-N-(cyclohexylmethyl)-2-N-ethyl-1-N,2-dimethylpropane-1,2-diamine
CID 62834837
4-[cyclopentylmethyl(methyl)amino]-2-(ethylamino)-2-methylbutan-1-ol
CID 64787817
2-methyl-5-[methyl(oxan-3-ylmethyl)amino]-2-(propylamino)pentan-1-ol
CID 64791814
3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64798088
5-[cyclopentylmethyl(methyl)amino]-2-ethyl-2-(propylamino)pentan-1-ol
CID 106808716
4-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)butan-1-ol
CID 64825256
3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide
CID 63925000

Frequently Asked Questions

What is the IUPAC name of 3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol?
The IUPAC name of 3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol (CID 64826426) is 3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol.
What is the SMILES notation for 3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol?
The canonical SMILES for 3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol is CCCNC(C)(CO)CN(C)CC1CCCCC1.
What is the InChIKey of 3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol?
The InChIKey is OPLVVKYWDLZSCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-4-10-16-15(2,13-18)12-17(3)11-14-8-6-5-7-9-14/h14,16,18H,4-13H2,1-3H3.
What are the key properties of 3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol?
3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol has a molecular weight of 256.43 g/mol, XLogP of 2.25, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol is sourced from PubChem (CID 64826426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).