2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide

C12H24N2O — CID 79796804

IUPAC2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide
SMILESCCCN(CC1CC1)C(=O)C(C)(N)CC
InChIInChI=1S/C12H24N2O/c1-4-8-14(9-10-6-7-10)11(15)12(3,13)5-2/h10H,4-9,13H2,1-3H3
InChIKeyOBFIEODIJFWMOA-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.76
Rot. Bonds6

About 2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide

2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide (PubChem CID 79796804) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide.

Molecular Properties

Compound Name2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide
PubChem CID79796804
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide
SMILESCCCN(CC1CC1)C(=O)C(C)(N)CC
InChIInChI=1S/C12H24N2O/c1-4-8-14(9-10-6-7-10)11(15)12(3,13)5-2/h10H,4-9,13H2,1-3H3
InChIKeyOBFIEODIJFWMOA-UHFFFAOYSA-N
XLogP1.76
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-amino-2-methylbutanoyl)-(cyclopropylmethyl)amino]acetic acid
CID 79805439
N-(cyclopropylmethyl)-N-propylacetamide
CID 59001159
ethyl N-(cyclopropylmethyl)-N-propylcarbamate
CID 60637808
2-[[cyclopropylmethyl(propyl)carbamoyl]amino]-2-methylpropanoic acid
CID 61443321
methyl N-(cyclopropylmethyl)-N-propylcarbamate
CID 115575376
3-amino-N-(cyclopropylmethyl)-5,5-dimethyl-N-propylhexanamide
CID 113496982
2-amino-N,2-dimethyl-N-(oxan-4-ylmethyl)butanamide
CID 79812019
2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-2-methylbutanamide
CID 114290733
2-amino-4-[cyclopropylmethyl(propyl)amino]-2-methylpentanamide
CID 64711426
N-(cyclopropylmethyl)-2-ethoxy-N-propylacetamide
CID 60637735
2-amino-N-(cyclobutylmethyl)-N-ethyl-2-methylpropanamide
CID 107398375
2-amino-2-methyl-N-propan-2-yl-N-propylbutanamide
CID 79796970

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide?
The IUPAC name of 2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide (CID 79796804) is 2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide.
What is the SMILES notation for 2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide?
The canonical SMILES for 2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide is CCCN(CC1CC1)C(=O)C(C)(N)CC.
What is the InChIKey of 2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide?
The InChIKey is OBFIEODIJFWMOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-4-8-14(9-10-6-7-10)11(15)12(3,13)5-2/h10H,4-9,13H2,1-3H3.
What are the key properties of 2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide?
2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide has a molecular weight of 212.34 g/mol, XLogP of 1.76, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(cyclopropylmethyl)-2-methyl-N-propylbutanamide is sourced from PubChem (CID 79796804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).