(cyclobutylamino)carbamic acid

C5H10N2O2 — CID 67059710

IUPAC(cyclobutylamino)carbamic acid
SMILESO=C(O)NNC1CCC1
InChIInChI=1S/C5H10N2O2/c8-5(9)7-6-4-2-1-3-4/h4,6-7H,1-3H2,(H,8,9)
InChIKeyDDERFALLZOGEQW-UHFFFAOYSA-N
MW130.15 g/mol
LogP0.31
Rot. Bonds2

About (cyclobutylamino)carbamic acid

(cyclobutylamino)carbamic acid (PubChem CID 67059710) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is (cyclobutylamino)carbamic acid.

Molecular Properties

Compound Name(cyclobutylamino)carbamic acid
PubChem CID67059710
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name(cyclobutylamino)carbamic acid
SMILESO=C(O)NNC1CCC1
InChIInChI=1S/C5H10N2O2/c8-5(9)7-6-4-2-1-3-4/h4,6-7H,1-3H2,(H,8,9)
InChIKeyDDERFALLZOGEQW-UHFFFAOYSA-N
XLogP0.31
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(cyclohexylamino)-3-hydroxyurea
CID 23526164
N-(cyclobutylamino)hydroxylamine
CID 155296994
N'-cyclopropylacetohydrazide
CID 53405132
(5-aminocyclooctyl)carbamic acid
CID 89189209
cyclohexylcarbamic acid;hydrate
CID 172719994
N'-cyclohexyl-3-methylbutanehydrazide
CID 22613406
tert-butyl N-(cyclododecylamino)carbamate
CID 107236860
[(4-butoxycyclohexyl)amino]carbamic acid
CID 150311178
(cyclopentylamino) hydrogen carbonate
CID 150964345
(3-methylcyclohexyl)carbamic acid
CID 67410451
[(4-ethoxycarbonyl-4-ethylcyclohexyl)amino]carbamic acid
CID 118383258
[(1S,3S)-3-carbamoylcyclohexyl]carbamic acid
CID 68629698

Frequently Asked Questions

What is the IUPAC name of (cyclobutylamino)carbamic acid?
The IUPAC name of (cyclobutylamino)carbamic acid (CID 67059710) is (cyclobutylamino)carbamic acid.
What is the SMILES notation for (cyclobutylamino)carbamic acid?
The canonical SMILES for (cyclobutylamino)carbamic acid is O=C(O)NNC1CCC1.
What is the InChIKey of (cyclobutylamino)carbamic acid?
The InChIKey is DDERFALLZOGEQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2/c8-5(9)7-6-4-2-1-3-4/h4,6-7H,1-3H2,(H,8,9).
What are the key properties of (cyclobutylamino)carbamic acid?
(cyclobutylamino)carbamic acid has a molecular weight of 130.15 g/mol, XLogP of 0.31, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (cyclobutylamino)carbamic acid is sourced from PubChem (CID 67059710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).