2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide

C10H20N2O — CID 62638239

IUPAC2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide
SMILESC=CCN(C(=O)C(C)NC)C(C)C
InChIInChI=1S/C10H20N2O/c1-6-7-12(8(2)3)10(13)9(4)11-5/h6,8-9,11H,1,7H2,2-5H3
InChIKeyBUMMTUUNFXNTEI-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.02
Rot. Bonds5

About 2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide

2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide (PubChem CID 62638239) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide.

Molecular Properties

Compound Name2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide
PubChem CID62638239
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide
SMILESC=CCN(C(=O)C(C)NC)C(C)C
InChIInChI=1S/C10H20N2O/c1-6-7-12(8(2)3)10(13)9(4)11-5/h6,8-9,11H,1,7H2,2-5H3
InChIKeyBUMMTUUNFXNTEI-UHFFFAOYSA-N
XLogP1.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-methyl-1-propan-2-yl-1-prop-2-enylurea
CID 115588417
2-(methylamino)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide
CID 62636977
3-tert-butyl-1-propan-2-yl-1-prop-2-enylurea
CID 115585835
6-amino-2-methyl-N-propan-2-yl-N-prop-2-enylheptanamide
CID 65291847
1-propan-2-yl-1-prop-2-enyl-3-propylurea
CID 115585837
(2S)-2-[2-methylpropanoyl(prop-2-enyl)amino]propanoic acid
CID 58153238
2-(cyclopropylmethylamino)-N-propan-2-yl-N-prop-2-enylacetamide
CID 60946878
2-[propan-2-yl(prop-2-enyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 60948460
2-chloro-N-phenyl-N-prop-2-enylpropanamide
CID 14417035
1-aminopropan-2-yl(prop-2-enyl)carbamic acid
CID 122620115
2-[1-[propan-2-yl(prop-2-enyl)carbamoyl]azetidin-3-yl]propanoic acid
CID 116683533
2-[propan-2-yl(prop-2-enyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978411

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide?
The IUPAC name of 2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide (CID 62638239) is 2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide.
What is the SMILES notation for 2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide?
The canonical SMILES for 2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide is C=CCN(C(=O)C(C)NC)C(C)C.
What is the InChIKey of 2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide?
The InChIKey is BUMMTUUNFXNTEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-6-7-12(8(2)3)10(13)9(4)11-5/h6,8-9,11H,1,7H2,2-5H3.
What are the key properties of 2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide?
2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide has a molecular weight of 184.28 g/mol, XLogP of 1.02, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-propan-2-yl-N-prop-2-enylpropanamide is sourced from PubChem (CID 62638239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).