4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide

C16H35N3O2 — CID 64710876

IUPAC4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide
SMILESCCC(C)N(CCOC)C(C)CC(C)(NC(C)C)C(N)=O
InChIInChI=1S/C16H35N3O2/c1-8-13(4)19(9-10-21-7)14(5)11-16(6,15(17)20)18-12(2)3/h12-14,18H,8-11H2,1-7H3,(H2,17,20)
InChIKeyQEOFAHFSAUXMGC-UHFFFAOYSA-N
MW301.48 g/mol
LogP1.75
Rot. Bonds11

About 4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide

4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide (PubChem CID 64710876) has the molecular formula C16H35N3O2 and a molecular weight of 301.48 g/mol. Its IUPAC name is 4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide.

Molecular Properties

Compound Name4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide
PubChem CID64710876
Molecular FormulaC16H35N3O2
Molecular Weight301.48 g/mol
Exact Mass301.27
IUPAC Name4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide
SMILESCCC(C)N(CCOC)C(C)CC(C)(NC(C)C)C(N)=O
InChIInChI=1S/C16H35N3O2/c1-8-13(4)19(9-10-21-7)14(5)11-16(6,15(17)20)18-12(2)3/h12-14,18H,8-11H2,1-7H3,(H2,17,20)
InChIKeyQEOFAHFSAUXMGC-UHFFFAOYSA-N
XLogP1.75
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.48
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol
CID 64827562
4-(diethylamino)-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64726179
4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide
CID 81061737
4-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpentanamide
CID 64710526
4-[2-methoxyethyl(2-methylpropyl)amino]-2-methyl-2-(methylamino)pentanamide
CID 64711225
4-ethoxy-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64707210
tert-butyl 2-[butan-2-yl(2-methoxyethyl)amino]propanoate
CID 64688775
4-[2-methoxyethyl(methyl)amino]-2-methyl-2-(propylamino)pentanamide
CID 64710690
4-(2-methoxyethoxy)-2-methyl-2-(methylamino)pentanamide
CID 64707377
4-[cyclopropyl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanoic acid
CID 64709693
ethyl 2-[butan-2-yl(2-methoxyethyl)amino]pentanoate
CID 83041497
3-(3-methoxypropylsulfanyl)-2-methyl-2-(propan-2-ylamino)propanamide
CID 63855423

Frequently Asked Questions

What is the IUPAC name of 4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide?
The IUPAC name of 4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide (CID 64710876) is 4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide.
What is the SMILES notation for 4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide?
The canonical SMILES for 4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide is CCC(C)N(CCOC)C(C)CC(C)(NC(C)C)C(N)=O.
What is the InChIKey of 4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide?
The InChIKey is QEOFAHFSAUXMGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N3O2/c1-8-13(4)19(9-10-21-7)14(5)11-16(6,15(17)20)18-12(2)3/h12-14,18H,8-11H2,1-7H3,(H2,17,20).
What are the key properties of 4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide?
4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide has a molecular weight of 301.48 g/mol, XLogP of 1.75, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide is sourced from PubChem (CID 64710876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).