N-(3-aminopropyl)-N-ethyl-2-propylpentanamide

C13H28N2O — CID 82984398

IUPACN-(3-aminopropyl)-N-ethyl-2-propylpentanamide
SMILESCCCC(CCC)C(=O)N(CC)CCCN
InChIInChI=1S/C13H28N2O/c1-4-8-12(9-5-2)13(16)15(6-3)11-7-10-14/h12H,4-11,14H2,1-3H3
InChIKeyRGIBOVARZCQKPN-UHFFFAOYSA-N
MW228.38 g/mol
LogP2.40
Rot. Bonds9

About N-(3-aminopropyl)-N-ethyl-2-propylpentanamide

N-(3-aminopropyl)-N-ethyl-2-propylpentanamide (PubChem CID 82984398) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-ethyl-2-propylpentanamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-ethyl-2-propylpentanamide
PubChem CID82984398
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC NameN-(3-aminopropyl)-N-ethyl-2-propylpentanamide
SMILESCCCC(CCC)C(=O)N(CC)CCCN
InChIInChI=1S/C13H28N2O/c1-4-8-12(9-5-2)13(16)15(6-3)11-7-10-14/h12H,4-11,14H2,1-3H3
InChIKeyRGIBOVARZCQKPN-UHFFFAOYSA-N
XLogP2.40
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromoethyl)-N-butyl-2-propylpentanamide
CID 82987659
N-(3-aminopropyl)-N-cycloheptyl-2-propylpentanamide
CID 82984278
N-(3-aminopropyl)-2-methyl-N-propylpropanamide
CID 43136612
N,N-diethyl-2-octyldodecanamide
CID 54517458
N-(3-amino-2-methyl-3-sulfanylidenepropyl)-N-ethyl-2-propylpentanamide
CID 82984934
2-(aminomethyl)-N-ethyl-N-(3-hydroxypropyl)-4,4-dimethylpentanamide
CID 107472719
N-(3-aminopropyl)-N-ethyldecanamide
CID 65447961
2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide
CID 43116469
N-(3-aminopropyl)-3-methyl-2-propan-2-yl-N-propylbutanamide
CID 114282132
N-(2-amino-2-sulfanylideneethyl)-N,2-dipropylpentanamide
CID 82985340
6-amino-2-propylhexanamide
CID 57133562
N-(2-aminoethyl)-N-cyclobutyl-2-propylpentanamide
CID 102874048

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-ethyl-2-propylpentanamide?
The IUPAC name of N-(3-aminopropyl)-N-ethyl-2-propylpentanamide (CID 82984398) is N-(3-aminopropyl)-N-ethyl-2-propylpentanamide.
What is the SMILES notation for N-(3-aminopropyl)-N-ethyl-2-propylpentanamide?
The canonical SMILES for N-(3-aminopropyl)-N-ethyl-2-propylpentanamide is CCCC(CCC)C(=O)N(CC)CCCN.
What is the InChIKey of N-(3-aminopropyl)-N-ethyl-2-propylpentanamide?
The InChIKey is RGIBOVARZCQKPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-4-8-12(9-5-2)13(16)15(6-3)11-7-10-14/h12H,4-11,14H2,1-3H3.
What are the key properties of N-(3-aminopropyl)-N-ethyl-2-propylpentanamide?
N-(3-aminopropyl)-N-ethyl-2-propylpentanamide has a molecular weight of 228.38 g/mol, XLogP of 2.40, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-ethyl-2-propylpentanamide is sourced from PubChem (CID 82984398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).