N-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

C14H28N2O — CID 66475600

IUPACN-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC(C)CC(CN)NC(=O)C1C(C)(C)C1(C)C
InChIInChI=1S/C14H28N2O/c1-9(2)7-10(8-15)16-12(17)11-13(3,4)14(11,5)6/h9-11H,7-8,15H2,1-6H3,(H,16,17)
InChIKeyWDISOBMEJTTZPL-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.16
Rot. Bonds5

About N-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

N-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (PubChem CID 66475600) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
PubChem CID66475600
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC(C)CC(CN)NC(=O)C1C(C)(C)C1(C)C
InChIInChI=1S/C14H28N2O/c1-9(2)7-10(8-15)16-12(17)11-13(3,4)14(11,5)6/h9-11H,7-8,15H2,1-6H3,(H,16,17)
InChIKeyWDISOBMEJTTZPL-UHFFFAOYSA-N
XLogP2.16
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1-amino-4-methylpentan-2-yl)carbamic acid
CID 19820731
N-(1-amino-4-methylpentan-2-yl)cycloheptanecarboxamide
CID 63755259
N-(1-amino-4-methylpentan-2-yl)cyclohexanecarboxamide;hydrochloride
CID 119260890
N-(1-amino-4-methylpentan-2-yl)-2-methylcyclopentane-1-carboxamide
CID 107180769
ethyl N-[(2S)-1-amino-4-methylpentan-2-yl]carbamate
CID 39869686
ethyl N-(1-amino-4-methylpentan-2-yl)carbamate
CID 43810663
N-(1-amino-4-methylpentan-2-yl)-2-cyclohexylcyclopropane-1-carboxamide;hydrochloride
CID 119585747
N-(1-amino-4-methylpentan-2-yl)-1-(2-methylpropanoyl)piperidine-4-carboxamide;hydrochloride
CID 119586427
N-(1-amino-4-methylpentan-2-yl)-2-tert-butylsulfanylacetamide
CID 63888731
N-(1-amino-4-methylpentan-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 103310367
N-(1-amino-4-methylpentan-2-yl)-4-butylcyclohexane-1-carboxamide
CID 63754544
N-(1-amino-4-methylpentan-2-yl)-2-cyclopentylacetamide
CID 63753245

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The IUPAC name of N-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (CID 66475600) is N-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The canonical SMILES for N-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is CC(C)CC(CN)NC(=O)C1C(C)(C)C1(C)C.
What is the InChIKey of N-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The InChIKey is WDISOBMEJTTZPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-9(2)7-10(8-15)16-12(17)11-13(3,4)14(11,5)6/h9-11H,7-8,15H2,1-6H3,(H,16,17).
What are the key properties of N-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
N-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide has a molecular weight of 240.39 g/mol, XLogP of 2.16, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-4-methylpentan-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is sourced from PubChem (CID 66475600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).