2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide

C14H26N2O — CID 61264857

IUPAC2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide
SMILESCC(C)(N)C(=O)N(CC1CCCCC1)C1CC1
InChIInChI=1S/C14H26N2O/c1-14(2,15)13(17)16(12-8-9-12)10-11-6-4-3-5-7-11/h11-12H,3-10,15H2,1-2H3
InChIKeyZZQYBQJBNSQSNC-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.30
Rot. Bonds4

About 2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide

2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide (PubChem CID 61264857) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide
PubChem CID61264857
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide
SMILESCC(C)(N)C(=O)N(CC1CCCCC1)C1CC1
InChIInChI=1S/C14H26N2O/c1-14(2,15)13(17)16(12-8-9-12)10-11-6-4-3-5-7-11/h11-12H,3-10,15H2,1-2H3
InChIKeyZZQYBQJBNSQSNC-UHFFFAOYSA-N
XLogP2.30
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide?
The IUPAC name of 2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide (CID 61264857) is 2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide?
The canonical SMILES for 2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide is CC(C)(N)C(=O)N(CC1CCCCC1)C1CC1.
What is the InChIKey of 2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide?
The InChIKey is ZZQYBQJBNSQSNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-14(2,15)13(17)16(12-8-9-12)10-11-6-4-3-5-7-11/h11-12H,3-10,15H2,1-2H3.
What are the key properties of 2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide?
2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide has a molecular weight of 238.37 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide is sourced from PubChem (CID 61264857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).