2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide

C15H24N4O2 — CID 61466725

IUPAC2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide
SMILESCCNC(C)c1cccc(NC(=O)NC(C)C(=O)NC)c1
InChIInChI=1S/C15H24N4O2/c1-5-17-10(2)12-7-6-8-13(9-12)19-15(21)18-11(3)14(20)16-4/h6-11,17H,5H2,1-4H3,(H,16,20)(H2,18,19,21)
InChIKeyKEZKYYKPVSFYBV-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.61
Rot. Bonds6

About 2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide

2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide (PubChem CID 61466725) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide.

Molecular Properties

Compound Name2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide
PubChem CID61466725
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide
SMILESCCNC(C)c1cccc(NC(=O)NC(C)C(=O)NC)c1
InChIInChI=1S/C15H24N4O2/c1-5-17-10(2)12-7-6-8-13(9-12)19-15(21)18-11(3)14(20)16-4/h6-11,17H,5H2,1-4H3,(H,16,20)(H2,18,19,21)
InChIKeyKEZKYYKPVSFYBV-UHFFFAOYSA-N
XLogP1.61
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.61
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-[1-(ethylamino)ethyl]phenyl]-3-pentan-3-ylurea
CID 61340352
N-[3-[1-(ethylamino)ethyl]phenyl]-2-methylpropanamide
CID 43507815
N-[3-[1-(ethylamino)ethyl]phenyl]-2-methylbutanamide
CID 43507836
1-(1-cyclopropylpropan-2-yl)-3-[3-[1-(ethylamino)ethyl]phenyl]urea
CID 63995585
2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]acetamide
CID 61339992
1-butan-2-yl-3-[3-[1-(methylamino)ethyl]phenyl]urea
CID 61341261
1-[3-[1-(ethylamino)ethyl]phenyl]-3-piperidin-1-ylurea
CID 83017066
1-[3-[1-(ethylamino)ethyl]phenyl]-3-(3,3,3-trifluoropropyl)urea
CID 63227876
1-[3-[1-(methylamino)ethyl]phenyl]-3-(2-methylpentan-3-yl)urea
CID 61471463
N-[3-[1-(ethylamino)ethyl]phenyl]furan-3-carboxamide
CID 43507852
1-[3-[1-(ethylamino)ethyl]phenyl]-3-(1H-imidazol-2-yl)urea
CID 63564699
1-[3-[1-(ethylamino)ethyl]phenyl]-3-(thiatriazol-5-yl)urea
CID 114913975

Frequently Asked Questions

What is the IUPAC name of 2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide?
The IUPAC name of 2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide (CID 61466725) is 2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide.
What is the SMILES notation for 2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide?
The canonical SMILES for 2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide is CCNC(C)c1cccc(NC(=O)NC(C)C(=O)NC)c1.
What is the InChIKey of 2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide?
The InChIKey is KEZKYYKPVSFYBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-5-17-10(2)12-7-6-8-13(9-12)19-15(21)18-11(3)14(20)16-4/h6-11,17H,5H2,1-4H3,(H,16,20)(H2,18,19,21).
What are the key properties of 2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide?
2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide has a molecular weight of 292.38 g/mol, XLogP of 1.61, 6 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide is sourced from PubChem (CID 61466725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).