N-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide

C15H24N4O2 — CID 119625989

IUPACN-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide
SMILESCc1ccccc1C(CC(=O)NCC(C)(C)N)NC(N)=O
InChIInChI=1S/C15H24N4O2/c1-10-6-4-5-7-11(10)12(19-14(16)21)8-13(20)18-9-15(2,3)17/h4-7,12H,8-9,17H2,1-3H3,(H,18,20)(H3,16,19,21)
InChIKeyKIFXLOUCQUQFOZ-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.95
Rot. Bonds6

About N-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide

N-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide (PubChem CID 119625989) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide
PubChem CID119625989
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide
SMILESCc1ccccc1C(CC(=O)NCC(C)(C)N)NC(N)=O
InChIInChI=1S/C15H24N4O2/c1-10-6-4-5-7-11(10)12(19-14(16)21)8-13(20)18-9-15(2,3)17/h4-7,12H,8-9,17H2,1-3H3,(H,18,20)(H3,16,19,21)
InChIKeyKIFXLOUCQUQFOZ-UHFFFAOYSA-N
XLogP0.95
TPSA110.24 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 ≤ 50.95
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-aminobutyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide;hydrochloride
CID 119495043
4-[[3-(carbamoylamino)-3-(2-methylphenyl)propanoyl]amino]butanoic acid
CID 119352945
2-[[[3-(carbamoylamino)-3-(2-methylphenyl)propanoyl]amino]methyl]-4-methylpentanoic acid
CID 122126211
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-3-(carbamoylamino)-3-(2-methylphenyl)propanamide;hydrochloride
CID 119525416
3-(carbamoylamino)-N-[2-(cycloheptylamino)ethyl]-3-(2-methylphenyl)propanamide
CID 119619279
3-acetamido-N-(2-amino-2-methylpropyl)-3-(2-ethoxyphenyl)propanamide
CID 119627423
N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(carbamoylamino)-3-(2-methylphenyl)propanamide
CID 86925589
3-(carbamoylamino)-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(2-methylphenyl)propanamide
CID 86925215
N-(1-amino-4-methylpentan-2-yl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide;hydrochloride
CID 119585603
3-(carbamoylamino)-N-[1-(5-methylfuran-2-yl)ethyl]-3-(2-methylphenyl)propanamide
CID 86980661
3-(carbamoylamino)-N-[1-(2-methylphenyl)ethyl]-3-thiophen-2-ylpropanamide
CID 42931334
(3R)-3-(carbamoylamino)-N-[(1R)-1-(2-methylphenyl)ethyl]-3-thiophen-2-ylpropanamide
CID 26081925

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide?
The IUPAC name of N-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide (CID 119625989) is N-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide?
The canonical SMILES for N-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide is Cc1ccccc1C(CC(=O)NCC(C)(C)N)NC(N)=O.
What is the InChIKey of N-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide?
The InChIKey is KIFXLOUCQUQFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-10-6-4-5-7-11(10)12(19-14(16)21)8-13(20)18-9-15(2,3)17/h4-7,12H,8-9,17H2,1-3H3,(H,18,20)(H3,16,19,21).
What are the key properties of N-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide?
N-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide has a molecular weight of 292.38 g/mol, XLogP of 0.95, 6 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-3-(carbamoylamino)-3-(2-methylphenyl)propanamide is sourced from PubChem (CID 119625989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).