4-methyl-2,2-bis(2-methylpropyl)pentanamide

C14H29NO — CID 170848547

IUPAC4-methyl-2,2-bis(2-methylpropyl)pentanamide
SMILESCC(C)CC(CC(C)C)(CC(C)C)C(N)=O
InChIInChI=1S/C14H29NO/c1-10(2)7-14(13(15)16,8-11(3)4)9-12(5)6/h10-12H,7-9H2,1-6H3,(H2,15,16)
InChIKeyAWEJGBVNOGKGTF-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.60
Rot. Bonds7

About 4-methyl-2,2-bis(2-methylpropyl)pentanamide

4-methyl-2,2-bis(2-methylpropyl)pentanamide (PubChem CID 170848547) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 4-methyl-2,2-bis(2-methylpropyl)pentanamide.

Molecular Properties

Compound Name4-methyl-2,2-bis(2-methylpropyl)pentanamide
PubChem CID170848547
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name4-methyl-2,2-bis(2-methylpropyl)pentanamide
SMILESCC(C)CC(CC(C)C)(CC(C)C)C(N)=O
InChIInChI=1S/C14H29NO/c1-10(2)7-14(13(15)16,8-11(3)4)9-12(5)6/h10-12H,7-9H2,1-6H3,(H2,15,16)
InChIKeyAWEJGBVNOGKGTF-UHFFFAOYSA-N
XLogP3.60
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-amino-2,4-dimethylpentanamide
CID 14037824
(2S)-2,4-dimethyl-2-propan-2-ylpentanamide
CID 89006805
2-carbamoyl-2,4-dimethylpentanoic acid
CID 114899918
(2S)-2-ethyl-2-hydroxy-4-methylpentanamide
CID 175974916
3-hydroxy-5-methyl-3-(2-methylpropyl)hexanamide
CID 139781275
5-methyl-3-(2-methylpropoxycarbonyl)-3-(2-methylpropyl)hexanoic acid
CID 89052204
3-methylbutanamide
CID 87933309
2-(aminomethyl)-2-(2,2-difluoroethyl)-4-methylpentanoic acid
CID 106488966
2-(aminomethyl)-2-(2-hydroxyethyl)-4-methylpentanoic acid
CID 106488991
3,3,5-trimethyl-2-methylidenehexanamide
CID 139781680
2-(aminomethyl)-2-(3-fluoropropyl)-4-methylpentanoic acid
CID 106489017
2-methylpropyl 2,2-diethylbutanoate
CID 139972882

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2,2-bis(2-methylpropyl)pentanamide?
The IUPAC name of 4-methyl-2,2-bis(2-methylpropyl)pentanamide (CID 170848547) is 4-methyl-2,2-bis(2-methylpropyl)pentanamide.
What is the SMILES notation for 4-methyl-2,2-bis(2-methylpropyl)pentanamide?
The canonical SMILES for 4-methyl-2,2-bis(2-methylpropyl)pentanamide is CC(C)CC(CC(C)C)(CC(C)C)C(N)=O.
What is the InChIKey of 4-methyl-2,2-bis(2-methylpropyl)pentanamide?
The InChIKey is AWEJGBVNOGKGTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-10(2)7-14(13(15)16,8-11(3)4)9-12(5)6/h10-12H,7-9H2,1-6H3,(H2,15,16).
What are the key properties of 4-methyl-2,2-bis(2-methylpropyl)pentanamide?
4-methyl-2,2-bis(2-methylpropyl)pentanamide has a molecular weight of 227.39 g/mol, XLogP of 3.60, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2,2-bis(2-methylpropyl)pentanamide is sourced from PubChem (CID 170848547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).