2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide

C14H28N2O — CID 79358922

IUPAC2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide
SMILESCCCC(CN)C(=O)NCC1C(C)(C)C1(C)C
InChIInChI=1S/C14H28N2O/c1-6-7-10(8-15)12(17)16-9-11-13(2,3)14(11,4)5/h10-11H,6-9,15H2,1-5H3,(H,16,17)
InChIKeyMLEXQCMHHLFNKI-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.16
Rot. Bonds6

About 2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide

2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide (PubChem CID 79358922) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide
PubChem CID79358922
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide
SMILESCCCC(CN)C(=O)NCC1C(C)(C)C1(C)C
InChIInChI=1S/C14H28N2O/c1-6-7-10(8-15)12(17)16-9-11-13(2,3)14(11,4)5/h10-11H,6-9,15H2,1-5H3,(H,16,17)
InChIKeyMLEXQCMHHLFNKI-UHFFFAOYSA-N
XLogP2.16
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
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

2-(aminomethyl)-N-[(4-hydroxycyclohexyl)methyl]pentanamide
CID 106135811
2-(aminomethyl)-3-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]butanamide
CID 79358528
2-(N'-hydroxycarbamimidoyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide
CID 79350952
2-(aminomethyl)-N-[(1-methylpyrrolidin-2-yl)methyl]pentanamide
CID 106024201
2-(aminomethyl)-N-(thiolan-3-ylmethyl)pentanamide
CID 107296139
4-[2-(aminomethyl)pentanoylamino]-2-methylbutanoic acid
CID 80539749
N-(3-amino-2-hydroxy-3-oxopropyl)-2-(aminomethyl)pentanamide
CID 106175532
(2S,3S)-2-amino-3-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide
CID 79363377
(2R)-2-amino-3,3-dimethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]butanamide
CID 103930174
2-(aminomethyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)pentanamide
CID 114629813
2-(aminomethyl)-N-[3-[methyl(propan-2-yl)amino]propyl]pentanamide
CID 114140198
2-(aminomethyl)-N-cyclopropylsulfonylpentanamide
CID 103308238

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide?
The IUPAC name of 2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide (CID 79358922) is 2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide.
What is the SMILES notation for 2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide?
The canonical SMILES for 2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide is CCCC(CN)C(=O)NCC1C(C)(C)C1(C)C.
What is the InChIKey of 2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide?
The InChIKey is MLEXQCMHHLFNKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-6-7-10(8-15)12(17)16-9-11-13(2,3)14(11,4)5/h10-11H,6-9,15H2,1-5H3,(H,16,17).
What are the key properties of 2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide?
2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide has a molecular weight of 240.39 g/mol, XLogP of 2.16, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pentanamide is sourced from PubChem (CID 79358922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).