2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide

C9H17N3O2 — CID 43116558

IUPAC2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)NCC1CC1
InChIInChI=1S/C9H17N3O2/c1-6(11-5-7-3-4-7)8(13)12-9(14)10-2/h6-7,11H,3-5H2,1-2H3,(H2,10,12,13,14)
InChIKeyMCLYYSHTJUMCGM-UHFFFAOYSA-N
MW199.25 g/mol
LogP-0.17
Rot. Bonds4

About 2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide

2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide (PubChem CID 43116558) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide
PubChem CID43116558
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)NCC1CC1
InChIInChI=1S/C9H17N3O2/c1-6(11-5-7-3-4-7)8(13)12-9(14)10-2/h6-7,11H,3-5H2,1-2H3,(H2,10,12,13,14)
InChIKeyMCLYYSHTJUMCGM-UHFFFAOYSA-N
XLogP-0.17
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-0.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide
CID 43317222
2-(2-cyclobutylethylamino)-N-(methylcarbamoyl)propanamide
CID 115688595
2-[(1,4-dimethylpiperazin-2-yl)methylamino]-N-(methylcarbamoyl)propanamide
CID 63897620
2-[(1-ethylpyrrolidin-2-yl)methylamino]-N-(methylcarbamoyl)propanamide
CID 43084476
2-(2-cyclopentyloxyethylamino)-N-(methylcarbamoyl)propanamide
CID 63826610
N-cyclopentyl-2-(cyclopropylmethylamino)propanamide
CID 43116561
methyl 2-(cyclopropylmethylamino)propanoate
CID 60780744
2-(3-methylbutylamino)-N-(methylcarbamoyl)propanamide
CID 43084446
N-cyclopropyl-2-[(4-hydroxycyclohexyl)methylamino]propanamide
CID 114147898
N-carbamoyl-2-[(3-hydroxycyclopentyl)methylamino]propanamide
CID 106129954
2-[(1-hydroxy-4,4-dimethylcyclohexyl)methylamino]-N-(methylcarbamoyl)propanamide
CID 65120855
ethyl 2-[[1-(methylcarbamoylamino)-1-oxopropan-2-yl]amino]acetate
CID 60811365

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide (CID 43116558) is 2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide is CNC(=O)NC(=O)C(C)NCC1CC1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide?
The InChIKey is MCLYYSHTJUMCGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O2/c1-6(11-5-7-3-4-7)8(13)12-9(14)10-2/h6-7,11H,3-5H2,1-2H3,(H2,10,12,13,14).
What are the key properties of 2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide?
2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide has a molecular weight of 199.25 g/mol, XLogP of -0.17, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide is sourced from PubChem (CID 43116558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).