[1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol

C15H30N2O — CID 79634395

IUPAC[1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol
SMILESCC(C)CN(C)C1CCCC(CO)(NC2CC2)C1
InChIInChI=1S/C15H30N2O/c1-12(2)10-17(3)14-5-4-8-15(9-14,11-18)16-13-6-7-13/h12-14,16,18H,4-11H2,1-3H3
InChIKeyNPBGCDDPONFRNG-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.00
Rot. Bonds6

About [1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol

[1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol (PubChem CID 79634395) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is [1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol
PubChem CID79634395
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name[1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol
SMILESCC(C)CN(C)C1CCCC(CO)(NC2CC2)C1
InChIInChI=1S/C15H30N2O/c1-12(2)10-17(3)14-5-4-8-15(9-14,11-18)16-13-6-7-13/h12-14,16,18H,4-11H2,1-3H3
InChIKeyNPBGCDDPONFRNG-UHFFFAOYSA-N
XLogP2.00
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(cyclopropylamino)-3-propan-2-ylcyclohexyl]methanol
CID 107450341
[1-(ethylamino)-3-[methyl(2-methylpropyl)amino]cyclopentyl]methanol
CID 79656684
[3-[methyl(3-methylbutyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol
CID 79640094
[3-[cyclopentylmethyl(methyl)amino]-1-(cyclopropylamino)cyclopentyl]methanol
CID 79656502
[1-(cyclopropylamino)-3-(3-methylbutylsulfanyl)cyclohexyl]methanol
CID 107764890
[3-[ethyl(methyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol
CID 79635385
[1-(cyclopentylamino)-3-propan-2-ylcyclohexyl]methanol
CID 107450338
[1-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]cyclohexyl]methanol
CID 102998353
[3-[2-(dimethylamino)ethyl-methylamino]-1-(propan-2-ylamino)cyclohexyl]methanol
CID 79635513
[3-[butyl(cyclopropyl)amino]-1-(cyclopropylamino)cyclohexyl]methanol
CID 79640161
[1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclohexyl]methanol
CID 79634544
[3-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-1-(methylamino)cyclohexyl]methanol
CID 79640784

Frequently Asked Questions

What is the IUPAC name of [1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol?
The IUPAC name of [1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol (CID 79634395) is [1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol.
What is the SMILES notation for [1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol?
The canonical SMILES for [1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol is CC(C)CN(C)C1CCCC(CO)(NC2CC2)C1.
What is the InChIKey of [1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol?
The InChIKey is NPBGCDDPONFRNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-12(2)10-17(3)14-5-4-8-15(9-14,11-18)16-13-6-7-13/h12-14,16,18H,4-11H2,1-3H3.
What are the key properties of [1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol?
[1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol has a molecular weight of 254.42 g/mol, XLogP of 2.00, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol is sourced from PubChem (CID 79634395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).