N-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide

C18H29N3O2 — CID 32974983

IUPACN-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide
SMILESCCCN(CCC)C(=O)CNc1cccc(NC(=O)CC)c1C
InChIInChI=1S/C18H29N3O2/c1-5-11-21(12-6-2)18(23)13-19-15-9-8-10-16(14(15)4)20-17(22)7-3/h8-10,19H,5-7,11-13H2,1-4H3,(H,20,22)
InChIKeyMPIOGSWAZMBVIV-UHFFFAOYSA-N
MW319.45 g/mol
LogP3.40
Rot. Bonds9

About N-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide

N-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide (PubChem CID 32974983) has the molecular formula C18H29N3O2 and a molecular weight of 319.45 g/mol. Its IUPAC name is N-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide.

Molecular Properties

Compound NameN-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide
PubChem CID32974983
Molecular FormulaC18H29N3O2
Molecular Weight319.45 g/mol
Exact Mass319.23
IUPAC NameN-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide
SMILESCCCN(CCC)C(=O)CNc1cccc(NC(=O)CC)c1C
InChIInChI=1S/C18H29N3O2/c1-5-11-21(12-6-2)18(23)13-19-15-9-8-10-16(14(15)4)20-17(22)7-3/h8-10,19H,5-7,11-13H2,1-4H3,(H,20,22)
InChIKeyMPIOGSWAZMBVIV-UHFFFAOYSA-N
XLogP3.40
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.45
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[2-(dipropylamino)acetyl]amino]-2-methylphenyl]propanamide
CID 54818982
N-[3-[[2-(3-chloro-2-methylanilino)acetyl]amino]-2-methylphenyl]propanamide
CID 54814911
N-[3-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]-2-methylphenyl]propanamide
CID 38773209
N-[3-[[2-(2-ethoxyanilino)-2-oxoethyl]amino]-2-methylphenyl]propanamide
CID 38773224
N-[3-[[2-(2-chloroanilino)acetyl]amino]-2-methylphenyl]propanamide
CID 54810419
N-[3-[[2-(3-acetamidoanilino)-2-oxoethyl]amino]-2-methylphenyl]propanamide
CID 54844990
N-[2-methyl-3-[[2-oxo-2-(2,4,5-trichloroanilino)ethyl]amino]phenyl]propanamide
CID 54844752
N-[2-methyl-3-[[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]amino]phenyl]propanamide
CID 47077586
2-(3-acetamido-2-methylanilino)-N,N-bis(prop-2-enyl)acetamide
CID 32972903
2-(2,6-diethylanilino)-N,N-dipropylacetamide
CID 109006644
N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide
CID 115949978
3-chloro-2,2-dimethyl-N-[2-methyl-3-(propanoylamino)phenyl]propanamide
CID 63680386

Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide?
The IUPAC name of N-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide (CID 32974983) is N-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide.
What is the SMILES notation for N-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide?
The canonical SMILES for N-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide is CCCN(CCC)C(=O)CNc1cccc(NC(=O)CC)c1C.
What is the InChIKey of N-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide?
The InChIKey is MPIOGSWAZMBVIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O2/c1-5-11-21(12-6-2)18(23)13-19-15-9-8-10-16(14(15)4)20-17(22)7-3/h8-10,19H,5-7,11-13H2,1-4H3,(H,20,22).
What are the key properties of N-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide?
N-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide has a molecular weight of 319.45 g/mol, XLogP of 3.40, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-(dipropylamino)-2-oxoethyl]amino]-2-methylphenyl]propanamide is sourced from PubChem (CID 32974983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).