4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide

C15H34N4O — CID 91126483

IUPAC4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide
SMILESCCNCCN(CCNCC)C(=O)CCC(C)NCC
InChIInChI=1S/C15H34N4O/c1-5-16-10-12-19(13-11-17-6-2)15(20)9-8-14(4)18-7-3/h14,16-18H,5-13H2,1-4H3
InChIKeyDRSBDNDIGXTBOS-UHFFFAOYSA-N
MW286.46 g/mol
LogP0.81
Rot. Bonds13

About 4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide

4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide (PubChem CID 91126483) has the molecular formula C15H34N4O and a molecular weight of 286.46 g/mol. Its IUPAC name is 4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide.

Molecular Properties

Compound Name4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide
PubChem CID91126483
Molecular FormulaC15H34N4O
Molecular Weight286.46 g/mol
Exact Mass286.27
IUPAC Name4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide
SMILESCCNCCN(CCNCC)C(=O)CCC(C)NCC
InChIInChI=1S/C15H34N4O/c1-5-16-10-12-19(13-11-17-6-2)15(20)9-8-14(4)18-7-3/h14,16-18H,5-13H2,1-4H3
InChIKeyDRSBDNDIGXTBOS-UHFFFAOYSA-N
XLogP0.81
TPSA56.40 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 50.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(ethylamino)-N,N-dipropylpropanamide
CID 62833888
2-(ethylamino)-N,N-bis(3-methylbutyl)acetamide
CID 60686802
N,N-diethyl-3-(hexan-2-ylamino)propanamide
CID 60926870
4-[ethyl-[3-(ethylamino)propyl]amino]-4-oxobutanoic acid
CID 142683451
3-(ethylamino)-N-(2-hydroxyethyl)-N-propan-2-ylbutanamide
CID 62838618
3-(ethylamino)butan-1-ol
CID 12636119
N,N-dipentyl-4-(propan-2-ylamino)butanamide
CID 60947135
3-N-ethyl-1-N-[4-[3-(ethylamino)butylamino]butyl]butane-1,3-diamine;tetrahydrochloride
CID 10181201
3-N-ethyl-1-N-[4-[3-(ethylamino)butylamino]butyl]butane-1,3-diamine;vanadium
CID 161302132
3-(ethylamino)-N,N-dimethylpropanamide
CID 60926487
3-formamido-N-(3-methylpentyl)-N-propylpropanamide
CID 177056535
tert-butyl N-[2-(ethylamino)ethyl]-N-(2-hydroxypropyl)carbamate
CID 107257153

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide?
The IUPAC name of 4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide (CID 91126483) is 4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide.
What is the SMILES notation for 4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide?
The canonical SMILES for 4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide is CCNCCN(CCNCC)C(=O)CCC(C)NCC.
What is the InChIKey of 4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide?
The InChIKey is DRSBDNDIGXTBOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34N4O/c1-5-16-10-12-19(13-11-17-6-2)15(20)9-8-14(4)18-7-3/h14,16-18H,5-13H2,1-4H3.
What are the key properties of 4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide?
4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide has a molecular weight of 286.46 g/mol, XLogP of 0.81, 13 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N,N-bis[2-(ethylamino)ethyl]pentanamide is sourced from PubChem (CID 91126483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).