N,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide

C10H18N4O3 — CID 62921745

IUPACN,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide
SMILESNC(=O)CN(CC(N)=O)C(=O)CCNC1CC1
InChIInChI=1S/C10H18N4O3/c11-8(15)5-14(6-9(12)16)10(17)3-4-13-7-1-2-7/h7,13H,1-6H2,(H2,11,15)(H2,12,16)
InChIKeyCFAOJMHSHMAFDP-UHFFFAOYSA-N
MW242.28 g/mol
LogP-2.07
Rot. Bonds8

About N,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide

N,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide (PubChem CID 62921745) has the molecular formula C10H18N4O3 and a molecular weight of 242.28 g/mol. Its IUPAC name is N,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide.

Molecular Properties

Compound NameN,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide
PubChem CID62921745
Molecular FormulaC10H18N4O3
Molecular Weight242.28 g/mol
Exact Mass242.14
IUPAC NameN,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide
SMILESNC(=O)CN(CC(N)=O)C(=O)CCNC1CC1
InChIInChI=1S/C10H18N4O3/c11-8(15)5-14(6-9(12)16)10(17)3-4-13-7-1-2-7/h7,13H,1-6H2,(H2,11,15)(H2,12,16)
InChIKeyCFAOJMHSHMAFDP-UHFFFAOYSA-N
XLogP-2.07
TPSA118.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 5-2.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-amino-2-oxoethyl)-3-(cyclopropylamino)-N-ethylpropanamide
CID 103101974
3-[(4-aminocyclohexyl)amino]-N,N-diethylpropanamide
CID 79731374
3-[3-(cyclopropylamino)propanoyl-ethylamino]propanoic acid
CID 62328828
N,N-dicyclohexyl-3-(cyclopropylamino)propanamide
CID 60842293
N-cyclopropyl-3-(cyclopropylamino)-N-ethylpropanamide
CID 60841219
2-[methyl-[4-(propylamino)cyclohexyl]amino]acetamide
CID 79122346
3-[(3-aminocyclobutyl)amino]-N,N-diethylpropanamide
CID 80560855
N-cyclobutyl-3-(cyclopropylamino)-N-(2-hydroxyethyl)propanamide
CID 102862128
3-[(1-methylpiperidin-4-yl)amino]propanamide
CID 43373494
3-[(4-tert-butylcyclohexyl)amino]-N,N-dimethylpropanamide
CID 54935093
3-[(1-acetylpiperidin-4-yl)amino]propanamide
CID 43224982
2-methoxyethyl 3-(cyclopropylamino)propanoate
CID 61301679

Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide?
The IUPAC name of N,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide (CID 62921745) is N,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide.
What is the SMILES notation for N,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide?
The canonical SMILES for N,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide is NC(=O)CN(CC(N)=O)C(=O)CCNC1CC1.
What is the InChIKey of N,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide?
The InChIKey is CFAOJMHSHMAFDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O3/c11-8(15)5-14(6-9(12)16)10(17)3-4-13-7-1-2-7/h7,13H,1-6H2,(H2,11,15)(H2,12,16).
What are the key properties of N,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide?
N,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide has a molecular weight of 242.28 g/mol, XLogP of -2.07, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-amino-2-oxoethyl)-3-(cyclopropylamino)propanamide is sourced from PubChem (CID 62921745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).