2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide

C14H28N2O — CID 119820261

IUPAC2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide
SMILESCC(C)CC(C)(C)CNC(=O)CNCC1CC1
InChIInChI=1S/C14H28N2O/c1-11(2)7-14(3,4)10-16-13(17)9-15-8-12-5-6-12/h11-12,15H,5-10H2,1-4H3,(H,16,17)
InChIKeyBBTFRVCAASWHDH-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.17
Rot. Bonds8

About 2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide

2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide (PubChem CID 119820261) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide
PubChem CID119820261
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide
SMILESCC(C)CC(C)(C)CNC(=O)CNCC1CC1
InChIInChI=1S/C14H28N2O/c1-11(2)7-14(3,4)10-16-13(17)9-15-8-12-5-6-12/h11-12,15H,5-10H2,1-4H3,(H,16,17)
InChIKeyBBTFRVCAASWHDH-UHFFFAOYSA-N
XLogP2.17
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopropylmethylamino)-N-(2-hydroxy-2-methylpropyl)acetamide
CID 65107560
2-(cyclopropylmethylamino)-N-(5-hydroxy-2,2-dimethylpentyl)acetamide
CID 106148251
2-(methylamino)-N-(2,2,4-trimethylpentyl)acetamide;hydrochloride
CID 119820253
N-(cyclopropylmethyl)-2-(2-methylpropylamino)acetamide
CID 28566205
2-[(4-hydroxycyclohexyl)methylamino]-N-(2-methylpropyl)acetamide
CID 106133696
2-pyrrolidin-2-yl-N-(2,2,4-trimethylpentyl)acetamide
CID 115160242
2-(cyclopropylmethylamino)-N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]acetamide
CID 119778674
2-(cyclopropylmethoxy)-N-(4-hydroxy-2,2-dimethylpentyl)acetamide
CID 111480165
3-[[2-(cyclopropylmethylamino)acetyl]amino]-2-methylpropanoic acid
CID 62675197
2-(cyclopropylmethylamino)-N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]acetamide
CID 119839560
2-[(4-hydroxycyclohexyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide
CID 106133433
tert-butyl 2-oxo-2-(2,2,4-trimethylpentylamino)acetate
CID 115141799

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide (CID 119820261) is 2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide is CC(C)CC(C)(C)CNC(=O)CNCC1CC1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide?
The InChIKey is BBTFRVCAASWHDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-11(2)7-14(3,4)10-16-13(17)9-15-8-12-5-6-12/h11-12,15H,5-10H2,1-4H3,(H,16,17).
What are the key properties of 2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide?
2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide has a molecular weight of 240.39 g/mol, XLogP of 2.17, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(2,2,4-trimethylpentyl)acetamide is sourced from PubChem (CID 119820261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).