2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide

C12H22N2O — CID 24700331

IUPAC2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide
SMILESC=CCN(CC=C)C(=O)C(N)CC(C)C
InChIInChI=1S/C12H22N2O/c1-5-7-14(8-6-2)12(15)11(13)9-10(3)4/h5-6,10-11H,1-2,7-9,13H2,3-4H3
InChIKeyPXSXXDVZXGYWQT-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.56
Rot. Bonds7

About 2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide

2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide (PubChem CID 24700331) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide.

Molecular Properties

Compound Name2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide
PubChem CID24700331
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide
SMILESC=CCN(CC=C)C(=O)C(N)CC(C)C
InChIInChI=1S/C12H22N2O/c1-5-7-14(8-6-2)12(15)11(13)9-10(3)4/h5-6,10-11H,1-2,7-9,13H2,3-4H3
InChIKeyPXSXXDVZXGYWQT-UHFFFAOYSA-N
XLogP1.56
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.56
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

2-amino-N-ethyl-4-methyl-N-prop-2-enylpentanamide
CID 81489014
2-[[(2R)-2-amino-4-methylpentanoyl]-prop-2-enylamino]acetic acid
CID 104903696
(2R)-2-amino-N-(2-methoxyethyl)-4-methyl-N-prop-2-enylpentanamide
CID 103338814
2-amino-3-methoxy-N,N-bis(prop-2-enyl)propanamide
CID 81081149
2-amino-N,N-diethyl-4-methylpentanamide
CID 24697294
(2S)-2-amino-N-ethyl-N-prop-2-enylbutanamide
CID 81425726
2-amino-4-methylsulfanyl-N,N-bis(prop-2-enyl)butanamide
CID 76892115
(2S)-2-amino-N,N-bis(2-amino-2-oxoethyl)-4-methylpentanamide
CID 62922094
2-amino-3,3-dimethyl-N,N-bis(prop-2-enyl)butanamide
CID 76892270
2-amino-N,4-dimethylpentanehydrazide
CID 116848873
(2S)-2-amino-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide
CID 104869516
(2R)-2-amino-N,N-bis(2-cyanoethyl)-4-methylpentanamide
CID 93376202

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide?
The IUPAC name of 2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide (CID 24700331) is 2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide.
What is the SMILES notation for 2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide?
The canonical SMILES for 2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide is C=CCN(CC=C)C(=O)C(N)CC(C)C.
What is the InChIKey of 2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide?
The InChIKey is PXSXXDVZXGYWQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-5-7-14(8-6-2)12(15)11(13)9-10(3)4/h5-6,10-11H,1-2,7-9,13H2,3-4H3.
What are the key properties of 2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide?
2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide has a molecular weight of 210.32 g/mol, XLogP of 1.56, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methyl-N,N-bis(prop-2-enyl)pentanamide is sourced from PubChem (CID 24700331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).