N-[(2R)-2,3,3-trimethylbutyl]acetamide

C9H19NO — CID 59118608

IUPACN-[(2R)-2,3,3-trimethylbutyl]acetamide
SMILESCC(=O)NC[C@H](C)C(C)(C)C
InChIInChI=1S/C9H19NO/c1-7(9(3,4)5)6-10-8(2)11/h7H,6H2,1-5H3,(H,10,11)/t7-/m0/s1
InChIKeyNUMBDDOOPNRHSU-ZETCQYMHSA-N
MW157.26 g/mol
LogP1.80
Rot. Bonds2

About N-[(2R)-2,3,3-trimethylbutyl]acetamide

N-[(2R)-2,3,3-trimethylbutyl]acetamide (PubChem CID 59118608) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is N-[(2R)-2,3,3-trimethylbutyl]acetamide.

Molecular Properties

Compound NameN-[(2R)-2,3,3-trimethylbutyl]acetamide
PubChem CID59118608
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC NameN-[(2R)-2,3,3-trimethylbutyl]acetamide
SMILESCC(=O)NC[C@H](C)C(C)(C)C
InChIInChI=1S/C9H19NO/c1-7(9(3,4)5)6-10-8(2)11/h7H,6H2,1-5H3,(H,10,11)/t7-/m0/s1
InChIKeyNUMBDDOOPNRHSU-ZETCQYMHSA-N
XLogP1.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(2,3,3-trimethylbutylamino)ethyl]acetamide
CID 107529863
N-(2,3,3-trimethylbutyl)prop-2-enamide
CID 83142372
2-oxo-2-(2,3,3-trimethylbutylamino)acetic acid
CID 83143356
1-propan-2-yl-3-(2,3,3-trimethylbutyl)urea
CID 115629659
2-(methylamino)-N-(2,3,3-trimethylbutyl)propanamide
CID 83143044
3-amino-2,2,3-trimethyl-N-(2,3,3-trimethylbutyl)butanamide
CID 83142759
3-methyl-2-sulfanyl-N-(2,3,3-trimethylbutyl)butanamide
CID 107034108
N-(3-acetamido-2-methylpropyl)acetamide
CID 20588188
3-chloro-2,2-dimethyl-N-(2,3,3-trimethylbutyl)propanamide
CID 83141302
(E)-N-(2,3,3-trimethylbutyl)but-2-enamide
CID 78965876
ethane;N-(2-methylpropyl)acetamide
CID 142232237
1-(2,2,2-trifluoroethyl)-3-(2,3,3-trimethylbutyl)urea
CID 115629640

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2,3,3-trimethylbutyl]acetamide?
The IUPAC name of N-[(2R)-2,3,3-trimethylbutyl]acetamide (CID 59118608) is N-[(2R)-2,3,3-trimethylbutyl]acetamide.
What is the SMILES notation for N-[(2R)-2,3,3-trimethylbutyl]acetamide?
The canonical SMILES for N-[(2R)-2,3,3-trimethylbutyl]acetamide is CC(=O)NC[C@H](C)C(C)(C)C.
What is the InChIKey of N-[(2R)-2,3,3-trimethylbutyl]acetamide?
The InChIKey is NUMBDDOOPNRHSU-ZETCQYMHSA-N. The full InChI is InChI=1S/C9H19NO/c1-7(9(3,4)5)6-10-8(2)11/h7H,6H2,1-5H3,(H,10,11)/t7-/m0/s1.
What are the key properties of N-[(2R)-2,3,3-trimethylbutyl]acetamide?
N-[(2R)-2,3,3-trimethylbutyl]acetamide has a molecular weight of 157.26 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2,3,3-trimethylbutyl]acetamide is sourced from PubChem (CID 59118608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).