2-(butylamino)-N-ethyl-N-methylpropanamide

C10H22N2O — CID 103107906

IUPAC2-(butylamino)-N-ethyl-N-methylpropanamide
SMILESCCCCNC(C)C(=O)N(C)CC
InChIInChI=1S/C10H22N2O/c1-5-7-8-11-9(3)10(13)12(4)6-2/h9,11H,5-8H2,1-4H3
InChIKeyATQVMTIDFCMCNX-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.24
Rot. Bonds6

About 2-(butylamino)-N-ethyl-N-methylpropanamide

2-(butylamino)-N-ethyl-N-methylpropanamide (PubChem CID 103107906) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 2-(butylamino)-N-ethyl-N-methylpropanamide.

Molecular Properties

Compound Name2-(butylamino)-N-ethyl-N-methylpropanamide
PubChem CID103107906
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name2-(butylamino)-N-ethyl-N-methylpropanamide
SMILESCCCCNC(C)C(=O)N(C)CC
InChIInChI=1S/C10H22N2O/c1-5-7-8-11-9(3)10(13)12(4)6-2/h9,11H,5-8H2,1-4H3
InChIKeyATQVMTIDFCMCNX-UHFFFAOYSA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-2-(hexylamino)-N-methylpropanamide
CID 103107347
methyl 4-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]butanoate
CID 103108728
N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide
CID 103108877
N-ethyl-2-[(3-hydroxy-3-methylbutyl)amino]-N-methylpropanamide
CID 103108355
2-(cyanomethylamino)-N-ethyl-N-methylpropanamide
CID 103108493
2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-methylpropanamide
CID 103108801
2-[(5-amino-5-hydroxyimino-4,4-dimethylpentyl)amino]-N-ethyl-N-methylpropanamide
CID 103110710
2-[(3-butoxy-2-hydroxypropyl)amino]-N-ethyl-N-methylpropanamide
CID 107263156
tert-butyl 3-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]propanoate
CID 103268735
N,N-dimethyl-2-(propylamino)propanamide
CID 43086179
N-ethyl-N-methyl-2-(propan-2-ylamino)propanamide
CID 103107904
2-(cyclopropylmethylamino)-N-ethyl-N-methylpropanamide
CID 103106979

Frequently Asked Questions

What is the IUPAC name of 2-(butylamino)-N-ethyl-N-methylpropanamide?
The IUPAC name of 2-(butylamino)-N-ethyl-N-methylpropanamide (CID 103107906) is 2-(butylamino)-N-ethyl-N-methylpropanamide.
What is the SMILES notation for 2-(butylamino)-N-ethyl-N-methylpropanamide?
The canonical SMILES for 2-(butylamino)-N-ethyl-N-methylpropanamide is CCCCNC(C)C(=O)N(C)CC.
What is the InChIKey of 2-(butylamino)-N-ethyl-N-methylpropanamide?
The InChIKey is ATQVMTIDFCMCNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-5-7-8-11-9(3)10(13)12(4)6-2/h9,11H,5-8H2,1-4H3.
What are the key properties of 2-(butylamino)-N-ethyl-N-methylpropanamide?
2-(butylamino)-N-ethyl-N-methylpropanamide has a molecular weight of 186.30 g/mol, XLogP of 1.24, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butylamino)-N-ethyl-N-methylpropanamide is sourced from PubChem (CID 103107906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).