4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide

C15H22N2O — CID 64919471

IUPAC4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide
SMILESCCC(Nc1ccc(C(=O)N(C)C)cc1)C1CC1
InChIInChI=1S/C15H22N2O/c1-4-14(11-5-6-11)16-13-9-7-12(8-10-13)15(18)17(2)3/h7-11,14,16H,4-6H2,1-3H3
InChIKeyIBUTVCMPDOVIGM-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.99
Rot. Bonds5

About 4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide

4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide (PubChem CID 64919471) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide.

Molecular Properties

Compound Name4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide
PubChem CID64919471
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide
SMILESCCC(Nc1ccc(C(=O)N(C)C)cc1)C1CC1
InChIInChI=1S/C15H22N2O/c1-4-14(11-5-6-11)16-13-9-7-12(8-10-13)15(18)17(2)3/h7-11,14,16H,4-6H2,1-3H3
InChIKeyIBUTVCMPDOVIGM-UHFFFAOYSA-N
XLogP2.99
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1-cyclopropylpropylamino)-N-prop-2-enylbenzamide
CID 64919057
4-(1-cyclopropylpropylamino)phenol
CID 64918837
N-(1-cyclopropylpropyl)-4-fluoroaniline
CID 64918794
N-[4-(1-cyclopropylpropylamino)phenyl]-2-methoxyacetamide
CID 64920329
N-(1-cyclopropylpropyl)aniline;hydrochloride
CID 174269039
4-(2-ethylbutanoylamino)-N,N-dimethylbenzamide
CID 17309176
N,N-dimethyl-4-(thian-4-ylamino)benzamide
CID 43682033
N,N-dimethyl-4-(5-methylhexan-2-ylamino)benzamide
CID 43681981
3-(1-cyclopropylpropylamino)-N-ethyl-4-methylbenzamide
CID 64918833
2-[4-(1-cyclopropylpropylamino)phenyl]acetonitrile
CID 64919481
4-(1-cyclopropylpropylamino)-N,3-dimethylbenzamide
CID 64917782
5-(1-cyclopropylpropylamino)-2-fluorobenzamide
CID 64917346

Frequently Asked Questions

What is the IUPAC name of 4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide?
The IUPAC name of 4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide (CID 64919471) is 4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide.
What is the SMILES notation for 4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide?
The canonical SMILES for 4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide is CCC(Nc1ccc(C(=O)N(C)C)cc1)C1CC1.
What is the InChIKey of 4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide?
The InChIKey is IBUTVCMPDOVIGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-4-14(11-5-6-11)16-13-9-7-12(8-10-13)15(18)17(2)3/h7-11,14,16H,4-6H2,1-3H3.
What are the key properties of 4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide?
4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide has a molecular weight of 246.35 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide is sourced from PubChem (CID 64919471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).