N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide

C11H24N4O2 — CID 119658379

IUPACN-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide
SMILESCC(NC(N)=O)C(=O)N(C)CCC(N)C(C)C
InChIInChI=1S/C11H24N4O2/c1-7(2)9(12)5-6-15(4)10(16)8(3)14-11(13)17/h7-9H,5-6,12H2,1-4H3,(H3,13,14,17)
InChIKeyFDYNJWFNOUPRDS-UHFFFAOYSA-N
MW244.34 g/mol
LogP-0.12
Rot. Bonds6

About N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide

N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide (PubChem CID 119658379) has the molecular formula C11H24N4O2 and a molecular weight of 244.34 g/mol. Its IUPAC name is N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide.

Molecular Properties

Compound NameN-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide
PubChem CID119658379
Molecular FormulaC11H24N4O2
Molecular Weight244.34 g/mol
Exact Mass244.19
IUPAC NameN-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide
SMILESCC(NC(N)=O)C(=O)N(C)CCC(N)C(C)C
InChIInChI=1S/C11H24N4O2/c1-7(2)9(12)5-6-15(4)10(16)8(3)14-11(13)17/h7-9H,5-6,12H2,1-4H3,(H3,13,14,17)
InChIKeyFDYNJWFNOUPRDS-UHFFFAOYSA-N
XLogP-0.12
TPSA101.45 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 5-0.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide?
The IUPAC name of N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide (CID 119658379) is N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide.
What is the SMILES notation for N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide?
The canonical SMILES for N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide is CC(NC(N)=O)C(=O)N(C)CCC(N)C(C)C.
What is the InChIKey of N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide?
The InChIKey is FDYNJWFNOUPRDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O2/c1-7(2)9(12)5-6-15(4)10(16)8(3)14-11(13)17/h7-9H,5-6,12H2,1-4H3,(H3,13,14,17).
What are the key properties of N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide?
N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide has a molecular weight of 244.34 g/mol, XLogP of -0.12, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide is sourced from PubChem (CID 119658379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).