2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide

C12H23N3O2 — CID 43317222

IUPAC2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide
SMILESCCNC(=O)NC(=O)C(C)NCC1CCCC1
InChIInChI=1S/C12H23N3O2/c1-3-13-12(17)15-11(16)9(2)14-8-10-6-4-5-7-10/h9-10,14H,3-8H2,1-2H3,(H2,13,15,16,17)
InChIKeyWUQKMPZDBBCJRX-UHFFFAOYSA-N
MW241.33 g/mol
LogP1.00
Rot. Bonds5

About 2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide

2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide (PubChem CID 43317222) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide
PubChem CID43317222
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide
SMILESCCNC(=O)NC(=O)C(C)NCC1CCCC1
InChIInChI=1S/C12H23N3O2/c1-3-13-12(17)15-11(16)9(2)14-8-10-6-4-5-7-10/h9-10,14H,3-8H2,1-2H3,(H2,13,15,16,17)
InChIKeyWUQKMPZDBBCJRX-UHFFFAOYSA-N
XLogP1.00
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 51.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylmethylamino)-N-(methylcarbamoyl)propanamide
CID 43116558
2-(cycloheptylamino)-N-(ethylcarbamoyl)propanamide
CID 43236392
2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide
CID 63996539
2-(cyclopentylmethylamino)propanoic acid
CID 61344306
4-[[[1-(ethylamino)-1-oxopropan-2-yl]amino]methyl]cyclohexane-1-carboxylic acid
CID 79531735
N-(ethylcarbamoyl)-2-(2-hydroxyethylamino)propanamide
CID 43389341
N-cyclopentyl-2-(cyclopropylmethylamino)propanamide
CID 43116561
N-(ethylcarbamoyl)-2-[(1-propylcyclopropyl)methylamino]propanamide
CID 113256759
2-(cyclohexylmethylamino)-N-prop-2-enylpropanamide
CID 43216208
N-(ethylcarbamoyl)-2-[(1-methylcyclopropyl)methylamino]propanamide
CID 103724729
2-(cyclohexylmethylamino)propanamide
CID 43216154
3-[[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]amino]propanoic acid
CID 43466733

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide?
The IUPAC name of 2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide (CID 43317222) is 2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide.
What is the SMILES notation for 2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide?
The canonical SMILES for 2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide is CCNC(=O)NC(=O)C(C)NCC1CCCC1.
What is the InChIKey of 2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide?
The InChIKey is WUQKMPZDBBCJRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-3-13-12(17)15-11(16)9(2)14-8-10-6-4-5-7-10/h9-10,14H,3-8H2,1-2H3,(H2,13,15,16,17).
What are the key properties of 2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide?
2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide has a molecular weight of 241.33 g/mol, XLogP of 1.00, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide is sourced from PubChem (CID 43317222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).