2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide

C16H35N3O — CID 43113241

IUPAC2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)NCCN(C(C)C)C(C)C
InChIInChI=1S/C16H35N3O/c1-8-9-14(6)18-16(20)15(7)17-10-11-19(12(2)3)13(4)5/h12-15,17H,8-11H2,1-7H3,(H,18,20)
InChIKeyQZRLTPLWDUWBQX-UHFFFAOYSA-N
MW285.48 g/mol
LogP2.39
Rot. Bonds10

About 2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide

2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide (PubChem CID 43113241) has the molecular formula C16H35N3O and a molecular weight of 285.48 g/mol. Its IUPAC name is 2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide.

Molecular Properties

Compound Name2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide
PubChem CID43113241
Molecular FormulaC16H35N3O
Molecular Weight285.48 g/mol
Exact Mass285.28
IUPAC Name2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)NCCN(C(C)C)C(C)C
InChIInChI=1S/C16H35N3O/c1-8-9-14(6)18-16(20)15(7)17-10-11-19(12(2)3)13(4)5/h12-15,17H,8-11H2,1-7H3,(H,18,20)
InChIKeyQZRLTPLWDUWBQX-UHFFFAOYSA-N
XLogP2.39
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.48
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(diethylamino)ethylamino]-N-pentan-2-ylpropanamide
CID 43112761
2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide
CID 62976128
2-(4-methylpentylamino)-N-pentan-2-ylpropanamide
CID 60745937
N-pentan-2-yl-2-(prop-2-enylamino)propanamide
CID 43113010
N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide
CID 43086354
4-[[1-oxo-1-(pentan-2-ylamino)propan-2-yl]amino]butanoic acid
CID 43473353
2-(3-butoxypropylamino)-N-pentan-2-ylpropanamide
CID 115577400
2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-pentan-2-ylpropanamide
CID 43420332
2-[(3-hydroxy-4-methoxybutyl)amino]-N-pentan-2-ylpropanamide
CID 114163574
(2R)-2-amino-N-[2-[di(propan-2-yl)amino]ethyl]pentanamide
CID 103813236
2-[2-[di(propan-2-yl)amino]ethylamino]-N-(3-methoxypropyl)propanamide
CID 43113238
2-[3-aminopropyl(propan-2-yl)amino]-N-pentan-2-ylpropanamide
CID 43137419

Frequently Asked Questions

What is the IUPAC name of 2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide?
The IUPAC name of 2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide (CID 43113241) is 2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide.
What is the SMILES notation for 2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide?
The canonical SMILES for 2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide is CCCC(C)NC(=O)C(C)NCCN(C(C)C)C(C)C.
What is the InChIKey of 2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide?
The InChIKey is QZRLTPLWDUWBQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N3O/c1-8-9-14(6)18-16(20)15(7)17-10-11-19(12(2)3)13(4)5/h12-15,17H,8-11H2,1-7H3,(H,18,20).
What are the key properties of 2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide?
2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide has a molecular weight of 285.48 g/mol, XLogP of 2.39, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide is sourced from PubChem (CID 43113241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).