2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide

C12H26N2O — CID 43086968

IUPAC2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide
SMILESCC(C)CCNC(C)C(=O)NCC(C)C
InChIInChI=1S/C12H26N2O/c1-9(2)6-7-13-11(5)12(15)14-8-10(3)4/h9-11,13H,6-8H2,1-5H3,(H,14,15)
InChIKeyYHUSAWCLAZQNIM-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.78
Rot. Bonds7

About 2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide

2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide (PubChem CID 43086968) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide
PubChem CID43086968
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide
SMILESCC(C)CCNC(C)C(=O)NCC(C)C
InChIInChI=1S/C12H26N2O/c1-9(2)6-7-13-11(5)12(15)14-8-10(3)4/h9-11,13H,6-8H2,1-5H3,(H,14,15)
InChIKeyYHUSAWCLAZQNIM-UHFFFAOYSA-N
XLogP1.78
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methylpentylamino)-N-(2-methylpropyl)propanamide
CID 60745845
2-(7-methyloctylamino)-N-(2-methylpropyl)propanamide
CID 103604994
2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide
CID 43553515
2-(butylamino)-N-(3-methylbutyl)propanamide
CID 43112967
2-(2-acetamidoethylamino)-N-(3-methylbutyl)propanamide
CID 43420237
N-(3-methylbutyl)-2-(3-methylsulfinylbutylamino)propanamide
CID 113490444
2-[[1-(3-methylbutylamino)-1-oxopropan-2-yl]amino]acetic acid
CID 43466192
2-[(2-amino-2-oxoethyl)amino]-N-(2-methylpropyl)propanamide
CID 43089259
2-[3-(2-methylpropoxy)propylamino]-N-(2-methylpropyl)propanamide
CID 103604221
(2R)-2-(3-methylbutylamino)propanoic acid
CID 20848021
2-(3-methylbutylamino)propanoic acid
CID 16769163
2-(3-methylbutylamino)-N-(methylcarbamoyl)propanamide
CID 43084446

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide?
The IUPAC name of 2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide (CID 43086968) is 2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide?
The canonical SMILES for 2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide is CC(C)CCNC(C)C(=O)NCC(C)C.
What is the InChIKey of 2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide?
The InChIKey is YHUSAWCLAZQNIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-9(2)6-7-13-11(5)12(15)14-8-10(3)4/h9-11,13H,6-8H2,1-5H3,(H,14,15).
What are the key properties of 2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide?
2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide has a molecular weight of 214.35 g/mol, XLogP of 1.78, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 43086968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).