N-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide

C10H19N3O3 — CID 62359652

IUPACN-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide
SMILESCC(NC1CCCCC1O)C(=O)NC(N)=O
InChIInChI=1S/C10H19N3O3/c1-6(9(15)13-10(11)16)12-7-4-2-3-5-8(7)14/h6-8,12,14H,2-5H2,1H3,(H3,11,13,15,16)
InChIKeyQMGDMNBGWTYXQL-UHFFFAOYSA-N
MW229.28 g/mol
LogP-0.54
Rot. Bonds3

About N-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide

N-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide (PubChem CID 62359652) has the molecular formula C10H19N3O3 and a molecular weight of 229.28 g/mol. Its IUPAC name is N-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide.

Molecular Properties

Compound NameN-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide
PubChem CID62359652
Molecular FormulaC10H19N3O3
Molecular Weight229.28 g/mol
Exact Mass229.14
IUPAC NameN-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide
SMILESCC(NC1CCCCC1O)C(=O)NC(N)=O
InChIInChI=1S/C10H19N3O3/c1-6(9(15)13-10(11)16)12-7-4-2-3-5-8(7)14/h6-8,12,14H,2-5H2,1H3,(H3,11,13,15,16)
InChIKeyQMGDMNBGWTYXQL-UHFFFAOYSA-N
XLogP-0.54
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 5-0.54
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-carbamoyl-2-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]amino]propanamide
CID 11939503
N-tert-butyl-2-[[(1S,2S)-2-hydroxycyclopentyl]amino]propanamide
CID 102733998
2-[(2-hydroxycyclohexyl)amino]-N,N-dimethylpropanamide
CID 61464464
2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-(2-methoxyethyl)propanamide
CID 102731613
N-carbamoyl-2-[[(1R)-1-cyclopentylethyl]amino]propanamide
CID 81394882
(2R)-2-(propan-2-ylamino)cycloheptan-1-ol
CID 166814951
N-carbamoyl-2-(1-cyclohexylethylamino)propanamide
CID 62405397
N-carbamoyl-2-[[(1R)-1-cycloheptylethyl]amino]propanamide
CID 81391633
trans-(1R,2R)-2-[[(1S)-1-cyclopropylethyl]amino]cyclohexan-1-ol
CID 124679605
4-[[1-(carbamoylamino)-1-oxopropan-2-yl]amino]cyclohexane-1-carboxamide
CID 54914283
2-(carbamoylamino)-N-[(1R,2R)-2-hydroxycyclohexyl]-3-methylbutanamide
CID 104931679
2-[[(1R)-1-cycloheptylethyl]amino]cycloheptan-1-ol
CID 81392910

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide?
The IUPAC name of N-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide (CID 62359652) is N-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide.
What is the SMILES notation for N-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide?
The canonical SMILES for N-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide is CC(NC1CCCCC1O)C(=O)NC(N)=O.
What is the InChIKey of N-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide?
The InChIKey is QMGDMNBGWTYXQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3/c1-6(9(15)13-10(11)16)12-7-4-2-3-5-8(7)14/h6-8,12,14H,2-5H2,1H3,(H3,11,13,15,16).
What are the key properties of N-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide?
N-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide has a molecular weight of 229.28 g/mol, XLogP of -0.54, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-[(2-hydroxycyclohexyl)amino]propanamide is sourced from PubChem (CID 62359652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).