[(2R)-1-(carbamoylamino)propan-2-yl]urea

C5H12N4O2 — CID 3246036

IUPAC[(2R)-1-(carbamoylamino)propan-2-yl]urea
SMILESC[C@H](CNC(N)=O)NC(N)=O
InChIInChI=1S/C5H12N4O2/c1-3(9-5(7)11)2-8-4(6)10/h3H,2H2,1H3,(H3,6,8,10)(H3,7,9,11)/t3-/m1/s1
InChIKeyJTZUXKIKHMIVSD-GSVOUGTGSA-N
MW160.18 g/mol
LogP-1.29
Rot. Bonds3

About [(2R)-1-(carbamoylamino)propan-2-yl]urea

[(2R)-1-(carbamoylamino)propan-2-yl]urea (PubChem CID 3246036) has the molecular formula C5H12N4O2 and a molecular weight of 160.18 g/mol. Its IUPAC name is [(2R)-1-(carbamoylamino)propan-2-yl]urea.

Molecular Properties

Compound Name[(2R)-1-(carbamoylamino)propan-2-yl]urea
PubChem CID3246036
Molecular FormulaC5H12N4O2
Molecular Weight160.18 g/mol
Exact Mass160.10
IUPAC Name[(2R)-1-(carbamoylamino)propan-2-yl]urea
SMILESC[C@H](CNC(N)=O)NC(N)=O
InChIInChI=1S/C5H12N4O2/c1-3(9-5(7)11)2-8-4(6)10/h3H,2H2,1H3,(H3,6,8,10)(H3,7,9,11)/t3-/m1/s1
InChIKeyJTZUXKIKHMIVSD-GSVOUGTGSA-N
XLogP-1.29
TPSA110.24 Ų
H-Bond Donors4
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.18
LogP ≤ 5-1.29
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 102

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Related Compounds

1-sulfanylpropan-2-ylurea
CID 89224596
2-methylbutylurea
CID 22179633
(3-amino-2-methyl-3-sulfanylidenepropyl)urea
CID 62666520
sodium 3-(carbamoylamino)-2-methylpropanoate
CID 175666948
[1-(carbamoylamino)-2-methylpropyl]urea
CID 22478
1-[(2S)-1-(carbamoylamino)-3-methylbutan-2-yl]-3-methylurea
CID 138640636
2-[(carbamoylamino)methyl]-3-methylbutanoic acid
CID 65218090
N-[2-(propanoylamino)propyl]propanamide
CID 3569677
2-pyrrolidin-1-ylpropylurea
CID 112728366
1-[(2S)-1-(carbamoylamino)propan-2-yl]-3-[5-(diaminomethylideneamino)-2-[[(2S)-2-[[5-(diaminomethylideneamino)-2-(methylamino)pentyl]carbamoylamino]propyl]carbamoylamino]pentyl]urea
CID 89084859
1-[2-(carbamoylamino)ethyl]-3-propan-2-ylurea
CID 116657505
[(2R)-2,3-dihydroxypropyl]urea
CID 88558789

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-(carbamoylamino)propan-2-yl]urea?
The IUPAC name of [(2R)-1-(carbamoylamino)propan-2-yl]urea (CID 3246036) is [(2R)-1-(carbamoylamino)propan-2-yl]urea.
What is the SMILES notation for [(2R)-1-(carbamoylamino)propan-2-yl]urea?
The canonical SMILES for [(2R)-1-(carbamoylamino)propan-2-yl]urea is C[C@H](CNC(N)=O)NC(N)=O.
What is the InChIKey of [(2R)-1-(carbamoylamino)propan-2-yl]urea?
The InChIKey is JTZUXKIKHMIVSD-GSVOUGTGSA-N. The full InChI is InChI=1S/C5H12N4O2/c1-3(9-5(7)11)2-8-4(6)10/h3H,2H2,1H3,(H3,6,8,10)(H3,7,9,11)/t3-/m1/s1.
What are the key properties of [(2R)-1-(carbamoylamino)propan-2-yl]urea?
[(2R)-1-(carbamoylamino)propan-2-yl]urea has a molecular weight of 160.18 g/mol, XLogP of -1.29, 3 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-(carbamoylamino)propan-2-yl]urea is sourced from PubChem (CID 3246036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).