2-formamido-N-propylpropanamide

C7H14N2O2 — CID 64990441

IUPAC2-formamido-N-propylpropanamide
SMILESCCCNC(=O)C(C)NC=O
InChIInChI=1S/C7H14N2O2/c1-3-4-8-7(11)6(2)9-5-10/h5-6H,3-4H2,1-2H3,(H,8,11)(H,9,10)
InChIKeyQDKDQEOWZKKMHL-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.35
Rot. Bonds5

About 2-formamido-N-propylpropanamide

2-formamido-N-propylpropanamide (PubChem CID 64990441) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 2-formamido-N-propylpropanamide.

Molecular Properties

Compound Name2-formamido-N-propylpropanamide
PubChem CID64990441
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name2-formamido-N-propylpropanamide
SMILESCCCNC(=O)C(C)NC=O
InChIInChI=1S/C7H14N2O2/c1-3-4-8-7(11)6(2)9-5-10/h5-6H,3-4H2,1-2H3,(H,8,11)(H,9,10)
InChIKeyQDKDQEOWZKKMHL-UHFFFAOYSA-N
XLogP-0.35
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-methyl-N-[1-oxo-1-(propylamino)propan-2-yl]propanamide
CID 60659584
2-[(1-hydroxy-2-methylpropan-2-yl)amino]-N-propylpropanamide
CID 43393041
2-(propan-2-ylcarbamoylamino)-N-propylpropanamide
CID 115579917
(2S)-2-[(2-chloroacetyl)amino]-N-propylpropanamide
CID 9207769
2-iodo-N-propylpropanamide
CID 64787589
2-(3-hydroxybutylamino)-N-propylpropanamide
CID 64913708
2-(carbamothioylamino)-N-propylpropanamide
CID 61476796
2,3-dihydroxy-N,N'-dipropylbutanediamide
CID 13226339
(2S)-N-(1-chloro-4-methyl-2-oxopentan-3-yl)-2-formamidopropanamide
CID 89055024
2-amino-N-propylpropanamide;ethane
CID 142837247
N-propyl-2-[(2,2,2-trifluoroacetyl)amino]propanamide
CID 62492310
2-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-N-propylpropanamide
CID 60677309

Frequently Asked Questions

What is the IUPAC name of 2-formamido-N-propylpropanamide?
The IUPAC name of 2-formamido-N-propylpropanamide (CID 64990441) is 2-formamido-N-propylpropanamide.
What is the SMILES notation for 2-formamido-N-propylpropanamide?
The canonical SMILES for 2-formamido-N-propylpropanamide is CCCNC(=O)C(C)NC=O.
What is the InChIKey of 2-formamido-N-propylpropanamide?
The InChIKey is QDKDQEOWZKKMHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-3-4-8-7(11)6(2)9-5-10/h5-6H,3-4H2,1-2H3,(H,8,11)(H,9,10).
What are the key properties of 2-formamido-N-propylpropanamide?
2-formamido-N-propylpropanamide has a molecular weight of 158.20 g/mol, XLogP of -0.35, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-formamido-N-propylpropanamide is sourced from PubChem (CID 64990441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).