ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide

C14H31N3O2 — CID 142388460

IUPACethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide
SMILESCC.CCCN(C)CC(=O)N(C)CC(=O)NC(C)C
InChIInChI=1S/C12H25N3O2.C2H6/c1-6-7-14(4)9-12(17)15(5)8-11(16)13-10(2)3;1-2/h10H,6-9H2,1-5H3,(H,13,16);1-2H3
InChIKeyCNOIMBKRTHQJGC-UHFFFAOYSA-N
MW273.42 g/mol
LogP1.34
Rot. Bonds7

About ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide

ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide (PubChem CID 142388460) has the molecular formula C14H31N3O2 and a molecular weight of 273.42 g/mol. Its IUPAC name is ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Nameethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide
PubChem CID142388460
Molecular FormulaC14H31N3O2
Molecular Weight273.42 g/mol
Exact Mass273.24
IUPAC Nameethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide
SMILESCC.CCCN(C)CC(=O)N(C)CC(=O)NC(C)C
InChIInChI=1S/C12H25N3O2.C2H6/c1-6-7-14(4)9-12(17)15(5)8-11(16)13-10(2)3;1-2/h10H,6-9H2,1-5H3,(H,13,16);1-2H3
InChIKeyCNOIMBKRTHQJGC-UHFFFAOYSA-N
XLogP1.34
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 60661823
diethyl 2-[3-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]propyl]propanedioate
CID 136571931
5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide
CID 79198624
3-amino-N,3-dimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]butanamide
CID 64685273
2-[methyl(methylcarbamoyl)amino]-N-propan-2-ylacetamide
CID 115575214
4-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]butanamide;hydrochloride
CID 119272108
2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 60937489
2-[[2-(4-ethoxyphenoxy)acetyl]-methylamino]-N-propan-2-ylacetamide
CID 9475810
N,N-diethyl-2-[methyl(propyl)amino]acetamide
CID 135175911
(2R)-2-[[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]carbamoyl]amino]propanoic acid
CID 78973916
2-bromo-N,2-dimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 114328087
ethane;2-[methyl(propyl)amino]acetic acid
CID 153373363

Frequently Asked Questions

What is the IUPAC name of ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide?
The IUPAC name of ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide (CID 142388460) is ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide.
What is the SMILES notation for ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide?
The canonical SMILES for ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide is CC.CCCN(C)CC(=O)N(C)CC(=O)NC(C)C.
What is the InChIKey of ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide?
The InChIKey is CNOIMBKRTHQJGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2.C2H6/c1-6-7-14(4)9-12(17)15(5)8-11(16)13-10(2)3;1-2/h10H,6-9H2,1-5H3,(H,13,16);1-2H3.
What are the key properties of ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide?
ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide has a molecular weight of 273.42 g/mol, XLogP of 1.34, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 142388460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).