3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide

C9H20N2O — CID 62853402

IUPAC3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide
SMILESCCNCC(C)C(=O)NC(C)C
InChIInChI=1S/C9H20N2O/c1-5-10-6-8(4)9(12)11-7(2)3/h7-8,10H,5-6H2,1-4H3,(H,11,12)
InChIKeySSKWKLAMRUSPIZ-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.76
Rot. Bonds5

About 3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide

3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide (PubChem CID 62853402) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide
PubChem CID62853402
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide
SMILESCCNCC(C)C(=O)NC(C)C
InChIInChI=1S/C9H20N2O/c1-5-10-6-8(4)9(12)11-7(2)3/h7-8,10H,5-6H2,1-4H3,(H,11,12)
InChIKeySSKWKLAMRUSPIZ-UHFFFAOYSA-N
XLogP0.76
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[3-(ethylamino)-2-methylpropanoyl]amino]-3-methylbutanamide
CID 106344993
2-[[3-(ethylamino)-2-methylpropanoyl]amino]pentanoic acid
CID 62837131
2-methyl-3-(methylamino)-N-propan-2-ylpropanamide
CID 79196226
3-(ethylamino)-2-methyl-N-(2-methylpropyl)propanamide
CID 62853586
2-methyl-N-propan-2-ylpentanamide
CID 4628268
3-(ethylamino)-2-methylpropanamide
CID 43311981
5-(ethylamino)-4-methylpent-1-en-3-one
CID 116565247
4-amino-2-[[3-(ethylamino)-2-methylpropanoyl]amino]-4-oxobutanoic acid
CID 55123175
N-cyclobutyl-3-(ethylamino)-2-methylpropanamide
CID 62839829
(2S)-2-[[3-(ethylamino)-2-methylpropanoyl]amino]-4-methoxy-4-oxobutanoic acid
CID 63307482
2-[[3-(ethylamino)-2-methylpropanoyl]amino]-N,N,4-trimethylpentanamide
CID 62852895
methyl 3-(ethylamino)-2-methylpropanoate
CID 3889298

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide?
The IUPAC name of 3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide (CID 62853402) is 3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide is CCNCC(C)C(=O)NC(C)C.
What is the InChIKey of 3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide?
The InChIKey is SSKWKLAMRUSPIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-5-10-6-8(4)9(12)11-7(2)3/h7-8,10H,5-6H2,1-4H3,(H,11,12).
What are the key properties of 3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide?
3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide has a molecular weight of 172.27 g/mol, XLogP of 0.76, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide is sourced from PubChem (CID 62853402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).