4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride

C15H33Cl2N3O — CID 119551609

IUPAC4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride
SMILESCCCN(CCC)CCCC(=O)N(C)C1CCNC1.Cl.Cl
InChIInChI=1S/C15H31N3O.2ClH/c1-4-10-18(11-5-2)12-6-7-15(19)17(3)14-8-9-16-13-14;;/h14,16H,4-13H2,1-3H3;2*1H
InChIKeyGETZZVICWLQAGA-UHFFFAOYSA-N
MW342.36 g/mol
LogP2.55
Rot. Bonds9

About 4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride

4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride (PubChem CID 119551609) has the molecular formula C15H33Cl2N3O and a molecular weight of 342.36 g/mol. Its IUPAC name is 4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride.

Molecular Properties

Compound Name4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride
PubChem CID119551609
Molecular FormulaC15H33Cl2N3O
Molecular Weight342.36 g/mol
Exact Mass341.20
IUPAC Name4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride
SMILESCCCN(CCC)CCCC(=O)N(C)C1CCNC1.Cl.Cl
InChIInChI=1S/C15H31N3O.2ClH/c1-4-10-18(11-5-2)12-6-7-15(19)17(3)14-8-9-16-13-14;;/h14,16H,4-13H2,1-3H3;2*1H
InChIKeyGETZZVICWLQAGA-UHFFFAOYSA-N
XLogP2.55
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.36
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide
CID 119551610
N',N'-diethyl-N-methyl-N-pyrrolidin-3-ylpentanediamide
CID 119550914
N-methyl-N-pyrrolidin-3-ylpropanamide
CID 60807525
N-[2-[methyl(pyrrolidin-3-yl)amino]-2-oxoethyl]butanamide;hydrochloride
CID 119553258
N',N'-diethyl-N-methyl-N-pyrrolidin-3-ylbutanediamide
CID 119554222
N,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide;hydrochloride
CID 119554778
N-methyl-N-piperidin-4-ylheptanamide
CID 115736784
N'-methyl-N-propyl-N'-pyrrolidin-3-ylbutanediamide;hydrochloride
CID 119553575
N-methyl-3-methylsulfanyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119553749
N-cyclopropyl-N-methyl-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921748
2,2-dimethyl-N-[4-[methyl(pyrrolidin-3-yl)amino]-4-oxobutyl]propanamide;hydrochloride
CID 119552565
4-(2-ethoxyphenoxy)-N-methyl-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119554526

Frequently Asked Questions

What is the IUPAC name of 4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride?
The IUPAC name of 4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride (CID 119551609) is 4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride.
What is the SMILES notation for 4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride?
The canonical SMILES for 4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride is CCCN(CCC)CCCC(=O)N(C)C1CCNC1.Cl.Cl.
What is the InChIKey of 4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride?
The InChIKey is GETZZVICWLQAGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O.2ClH/c1-4-10-18(11-5-2)12-6-7-15(19)17(3)14-8-9-16-13-14;;/h14,16H,4-13H2,1-3H3;2*1H.
What are the key properties of 4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride?
4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride has a molecular weight of 342.36 g/mol, XLogP of 2.55, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride is sourced from PubChem (CID 119551609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).