2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol

C16H33N3O — CID 64798033

IUPAC2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol
SMILESCC(CC(C)(CO)NC1CC1)N(C)C1CCN(C)CC1
InChIInChI=1S/C16H33N3O/c1-13(11-16(2,12-20)17-14-5-6-14)19(4)15-7-9-18(3)10-8-15/h13-15,17,20H,5-12H2,1-4H3
InChIKeyKSVKPJWVHOJNND-UHFFFAOYSA-N
MW283.46 g/mol
LogP1.29
Rot. Bonds7

About 2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol

2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol (PubChem CID 64798033) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is 2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol
PubChem CID64798033
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC Name2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol
SMILESCC(CC(C)(CO)NC1CC1)N(C)C1CCN(C)CC1
InChIInChI=1S/C16H33N3O/c1-13(11-16(2,12-20)17-14-5-6-14)19(4)15-7-9-18(3)10-8-15/h13-15,17,20H,5-12H2,1-4H3
InChIKeyKSVKPJWVHOJNND-UHFFFAOYSA-N
XLogP1.29
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-2-(methylamino)-4-[methyl-(1-methylpiperidin-4-yl)amino]pentanoic acid
CID 64725416
1-N-cyclopropyl-2-N-methyl-2-N-(1-methylpiperidin-4-yl)propane-1,2-diamine
CID 62425020
2-(cyclopropylamino)-2-methyl-4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]pentan-1-ol
CID 79317831
2-(cyclopropylamino)-2-methyl-4-[methyl(4-methylpentan-2-yl)amino]pentan-1-ol
CID 64826988
2-methyl-2-(methylamino)-4-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol
CID 64790464
2-methyl-4-[methyl-(4-methylcyclohexyl)amino]-2-(propylamino)pentan-1-ol
CID 64827999
2-(ethylamino)-4-[(4-ethylcyclohexyl)-methylamino]-2-methylpentan-1-ol
CID 64825627
1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine
CID 115920386
4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-2-ol
CID 64718593
N,1-dimethyl-N-pentan-2-ylpiperidin-4-amine
CID 142253638
2-(cyclopropylamino)-2-methyl-5-[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]pentan-1-ol
CID 64788794
2-ethyl-2-[(1-methylpiperidin-4-yl)amino]propane-1,3-diol
CID 115927628

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol (CID 64798033) is 2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol is CC(CC(C)(CO)NC1CC1)N(C)C1CCN(C)CC1.
What is the InChIKey of 2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol?
The InChIKey is KSVKPJWVHOJNND-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-13(11-16(2,12-20)17-14-5-6-14)19(4)15-7-9-18(3)10-8-15/h13-15,17,20H,5-12H2,1-4H3.
What are the key properties of 2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol?
2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol has a molecular weight of 283.46 g/mol, XLogP of 1.29, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol is sourced from PubChem (CID 64798033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).