4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide

C15H32N2O2 — CID 167080036

IUPAC4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide
SMILESCCNC(C)CCOC(C)CCC(=O)NCC(C)C
InChIInChI=1S/C15H32N2O2/c1-6-16-13(4)9-10-19-14(5)7-8-15(18)17-11-12(2)3/h12-14,16H,6-11H2,1-5H3,(H,17,18)
InChIKeyMEHQGFOMPZAJIE-UHFFFAOYSA-N
MW272.43 g/mol
LogP2.33
Rot. Bonds11

About 4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide

4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide (PubChem CID 167080036) has the molecular formula C15H32N2O2 and a molecular weight of 272.43 g/mol. Its IUPAC name is 4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide.

Molecular Properties

Compound Name4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide
PubChem CID167080036
Molecular FormulaC15H32N2O2
Molecular Weight272.43 g/mol
Exact Mass272.25
IUPAC Name4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide
SMILESCCNC(C)CCOC(C)CCC(=O)NCC(C)C
InChIInChI=1S/C15H32N2O2/c1-6-16-13(4)9-10-19-14(5)7-8-15(18)17-11-12(2)3/h12-14,16H,6-11H2,1-5H3,(H,17,18)
InChIKeyMEHQGFOMPZAJIE-UHFFFAOYSA-N
XLogP2.33
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-4-pentan-2-yloxybutan-2-amine
CID 102981250
N-[(2R)-2-(ethylamino)propyl]-4-methylpentanamide;hydrochloride
CID 120650462
N-[(2R)-2-(ethylamino)propyl]-3-propan-2-yloxypropanamide
CID 120655011
3-[2-methyl-4-(4-propan-2-yloxybutan-2-yloxy)butan-2-yl]oxy-N-(2-methylpropyl)propanamide
CID 176948813
3-(ethylamino)-N-(2-methylpropyl)propanamide
CID 62832271
N-ethyl-3-(4-methoxybutan-2-ylamino)propanamide
CID 64603036
2-(ethylamino)-4-pentan-2-yloxybutanoic acid
CID 102984247
(3R,5S)-1-N,3-N,5-N,7-N-tetrakis(2-methylpropyl)heptane-1,3,5,7-tetracarboxamide
CID 102254878
N-(4-methylpentyl)-3-[3-(2-methylpropylamino)-3-oxopropoxy]propanamide
CID 177260511
4-(2-methylpropoxy)-N-(2-methylpropyl)butanamide
CID 177120223
3-[3-(ethylamino)butanoylamino]-2-methylpropanoic acid
CID 62833119
N-(2-methylpropyl)-3-[2-(3-oxobutoxy)ethoxy]propanamide
CID 156820477

Frequently Asked Questions

What is the IUPAC name of 4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide?
The IUPAC name of 4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide (CID 167080036) is 4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide.
What is the SMILES notation for 4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide?
The canonical SMILES for 4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide is CCNC(C)CCOC(C)CCC(=O)NCC(C)C.
What is the InChIKey of 4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide?
The InChIKey is MEHQGFOMPZAJIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O2/c1-6-16-13(4)9-10-19-14(5)7-8-15(18)17-11-12(2)3/h12-14,16H,6-11H2,1-5H3,(H,17,18).
What are the key properties of 4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide?
4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide has a molecular weight of 272.43 g/mol, XLogP of 2.33, 11 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(ethylamino)butoxy]-N-(2-methylpropyl)pentanamide is sourced from PubChem (CID 167080036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).