4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride

C16H35Cl2N3O — CID 120602359

IUPAC4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride
SMILESCCCN(CCC)CCCC(=O)NC1CCNC(C)C1.Cl.Cl
InChIInChI=1S/C16H33N3O.2ClH/c1-4-10-19(11-5-2)12-6-7-16(20)18-15-8-9-17-14(3)13-15;;/h14-15,17H,4-13H2,1-3H3,(H,18,20);2*1H
InChIKeyNUORUKGFVHVHPA-UHFFFAOYSA-N
MW356.38 g/mol
LogP2.99
Rot. Bonds9

About 4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride

4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride (PubChem CID 120602359) has the molecular formula C16H35Cl2N3O and a molecular weight of 356.38 g/mol. Its IUPAC name is 4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride.

Molecular Properties

Compound Name4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride
PubChem CID120602359
Molecular FormulaC16H35Cl2N3O
Molecular Weight356.38 g/mol
Exact Mass355.22
IUPAC Name4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride
SMILESCCCN(CCC)CCCC(=O)NC1CCNC(C)C1.Cl.Cl
InChIInChI=1S/C16H33N3O.2ClH/c1-4-10-19(11-5-2)12-6-7-16(20)18-15-8-9-17-14(3)13-15;;/h14-15,17H,4-13H2,1-3H3,(H,18,20);2*1H
InChIKeyNUORUKGFVHVHPA-UHFFFAOYSA-N
XLogP2.99
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.38
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylpiperidin-4-yl)hexanamide
CID 106995560
3-(dimethylamino)-N-(2-methylpiperidin-4-yl)propanamide
CID 106995184
4,4,4-trifluoro-N-(2-methylpiperidin-4-yl)butanamide
CID 106995303
2-cyclobutyl-N-(2-methylpiperidin-4-yl)acetamide;hydrochloride
CID 120599149
3-methyl-N-(2-methylpiperidin-4-yl)hexanamide
CID 120598747
3-[3-aminopropyl(propyl)amino]-N-cyclopropylpropanamide
CID 62628089
4-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-methylpiperidin-4-yl)butanamide;hydrochloride
CID 120601198
N-(2-methylpiperidin-4-yl)-2-phenylacetamide;hydrochloride
CID 120599481
N-(2-methylpiperidin-4-yl)-3-pyrazol-1-ylpropanamide
CID 106995080
[(2R,4R)-2-methylpiperidin-4-yl]carbamic acid
CID 146485805
N-piperidin-4-ylhexanamide;hydrochloride
CID 47002713
4-methyl-N-(2-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 106995297

Frequently Asked Questions

What is the IUPAC name of 4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride?
The IUPAC name of 4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride (CID 120602359) is 4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride.
What is the SMILES notation for 4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride?
The canonical SMILES for 4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride is CCCN(CCC)CCCC(=O)NC1CCNC(C)C1.Cl.Cl.
What is the InChIKey of 4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride?
The InChIKey is NUORUKGFVHVHPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O.2ClH/c1-4-10-19(11-5-2)12-6-7-16(20)18-15-8-9-17-14(3)13-15;;/h14-15,17H,4-13H2,1-3H3,(H,18,20);2*1H.
What are the key properties of 4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride?
4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride has a molecular weight of 356.38 g/mol, XLogP of 2.99, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dipropylamino)-N-(2-methylpiperidin-4-yl)butanamide;dihydrochloride is sourced from PubChem (CID 120602359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).