3-(carbamoylamino)-N-methylpropanamide

C5H11N3O2 — CID 60667661

IUPAC3-(carbamoylamino)-N-methylpropanamide
SMILESCNC(=O)CCNC(N)=O
InChIInChI=1S/C5H11N3O2/c1-7-4(9)2-3-8-5(6)10/h2-3H2,1H3,(H,7,9)(H3,6,8,10)
InChIKeyJNBNTQDQGHOQSU-UHFFFAOYSA-N
MW145.16 g/mol
LogP-1.21
Rot. Bonds3

About 3-(carbamoylamino)-N-methylpropanamide

3-(carbamoylamino)-N-methylpropanamide (PubChem CID 60667661) has the molecular formula C5H11N3O2 and a molecular weight of 145.16 g/mol. Its IUPAC name is 3-(carbamoylamino)-N-methylpropanamide.

Molecular Properties

Compound Name3-(carbamoylamino)-N-methylpropanamide
PubChem CID60667661
Molecular FormulaC5H11N3O2
Molecular Weight145.16 g/mol
Exact Mass145.09
IUPAC Name3-(carbamoylamino)-N-methylpropanamide
SMILESCNC(=O)CCNC(N)=O
InChIInChI=1S/C5H11N3O2/c1-7-4(9)2-3-8-5(6)10/h2-3H2,1H3,(H,7,9)(H3,6,8,10)
InChIKeyJNBNTQDQGHOQSU-UHFFFAOYSA-N
XLogP-1.21
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-1.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N'-[3-(methylamino)-3-oxopropyl]butanediamide
CID 10680195
N-methyl-3-[(N'-methylcarbamimidoyl)amino]propanamide
CID 62359742
ethyl N-[3-(methylamino)-3-oxopropyl]carbamate
CID 60762452
1-[8-(carbamoylamino)octyl]-3-methylurea
CID 129172713
3-oxopentylurea
CID 19425945
4-chloro-N-[3-(methylamino)-3-oxopropyl]butanamide
CID 63308286
5-hydroxy-N-[3-(methylamino)-3-oxopropyl]pentanamide
CID 79209725
N-methyl-3-(propylcarbamothioylamino)propanamide
CID 116508065
N-[2-(carbamoylamino)ethyl]propanamide
CID 78993883
2-[2-[[3-(methylamino)-3-oxopropyl]amino]-2-oxoethyl]sulfanylacetic acid
CID 104569799
2,3-bis(methylamino)-N-[3-(methylamino)-3-oxopropyl]propanamide
CID 58422041
ethane;2-hydroxyethylurea
CID 144763401

Frequently Asked Questions

What is the IUPAC name of 3-(carbamoylamino)-N-methylpropanamide?
The IUPAC name of 3-(carbamoylamino)-N-methylpropanamide (CID 60667661) is 3-(carbamoylamino)-N-methylpropanamide.
What is the SMILES notation for 3-(carbamoylamino)-N-methylpropanamide?
The canonical SMILES for 3-(carbamoylamino)-N-methylpropanamide is CNC(=O)CCNC(N)=O.
What is the InChIKey of 3-(carbamoylamino)-N-methylpropanamide?
The InChIKey is JNBNTQDQGHOQSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N3O2/c1-7-4(9)2-3-8-5(6)10/h2-3H2,1H3,(H,7,9)(H3,6,8,10).
What are the key properties of 3-(carbamoylamino)-N-methylpropanamide?
3-(carbamoylamino)-N-methylpropanamide has a molecular weight of 145.16 g/mol, XLogP of -1.21, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(carbamoylamino)-N-methylpropanamide is sourced from PubChem (CID 60667661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).