2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol

C15H32N2O — CID 64826804

IUPAC2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol
SMILESCC(C)CN(CCC(C)(CO)NC1CC1)C(C)C
InChIInChI=1S/C15H32N2O/c1-12(2)10-17(13(3)4)9-8-15(5,11-18)16-14-6-7-14/h12-14,16,18H,6-11H2,1-5H3
InChIKeyVTUOFMRYDUSBDF-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.25
Rot. Bonds9

About 2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol

2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol (PubChem CID 64826804) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol
PubChem CID64826804
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol
SMILESCC(C)CN(CCC(C)(CO)NC1CC1)C(C)C
InChIInChI=1S/C15H32N2O/c1-12(2)10-17(13(3)4)9-8-15(5,11-18)16-14-6-7-14/h12-14,16,18H,6-11H2,1-5H3
InChIKeyVTUOFMRYDUSBDF-UHFFFAOYSA-N
XLogP2.25
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
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

2-(cyclopropylamino)-2-methyl-5-[pentyl(propan-2-yl)amino]pentan-1-ol
CID 64827354
2-(cyclopropylamino)-6-[cyclopropylmethyl(propan-2-yl)amino]-2-methylhexan-1-ol
CID 64825233
3-[bis(2-methylpropyl)amino]-2-(cyclopropylamino)-2-methylpropan-1-ol
CID 64828074
2-(cyclopropylamino)-4-[2-methoxyethyl(pentan-3-yl)amino]-2-methylbutan-1-ol
CID 64825611
2-(cyclopropylamino)-2-methyl-6-[methyl(3-methylbutyl)amino]hexan-1-ol
CID 64826615
2-(ethylamino)-2-methyl-5-[2-methylpropyl(propan-2-yl)amino]pentan-1-ol
CID 64828003
2-methyl-5-[2-methylpropyl(propan-2-yl)amino]-2-(propylamino)pentan-1-ol
CID 64827398
2-(cyclopropylamino)-2-methyl-5-[methyl(2-methylbutyl)amino]pentan-1-ol
CID 64797672
4-[cyclohexyl(ethyl)amino]-2-(cyclopropylamino)-2-methylbutan-1-ol
CID 64798397
4-tert-butylsulfanyl-2-(cyclopropylamino)-2-methylbutan-1-ol
CID 64818836
2-methyl-2-[(4-methylcyclohexyl)amino]pentan-1-ol
CID 115907238
4-[cyclopropyl(2-methylpropyl)amino]-2-(ethylamino)-2-methylbutan-1-ol
CID 64826138

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol (CID 64826804) is 2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol is CC(C)CN(CCC(C)(CO)NC1CC1)C(C)C.
What is the InChIKey of 2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol?
The InChIKey is VTUOFMRYDUSBDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-12(2)10-17(13(3)4)9-8-15(5,11-18)16-14-6-7-14/h12-14,16,18H,6-11H2,1-5H3.
What are the key properties of 2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol?
2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol has a molecular weight of 256.43 g/mol, XLogP of 2.25, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]butan-1-ol is sourced from PubChem (CID 64826804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).