N,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide

C22H47N3O — CID 155175016

IUPACN,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide
SMILESCC(=O)N(C(C)(C)CC(C)(C)NC(C)C)C(C)(C)CC(C)(C)NC(C)C
InChIInChI=1S/C22H47N3O/c1-16(2)23-19(6,7)14-21(10,11)25(18(5)26)22(12,13)15-20(8,9)24-17(3)4/h16-17,23-24H,14-15H2,1-13H3
InChIKeyCEJIYDHYGUDOQC-UHFFFAOYSA-N
MW369.64 g/mol
LogP4.73
Rot. Bonds10

About N,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide

N,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide (PubChem CID 155175016) has the molecular formula C22H47N3O and a molecular weight of 369.64 g/mol. Its IUPAC name is N,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide.

Molecular Properties

Compound NameN,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide
PubChem CID155175016
Molecular FormulaC22H47N3O
Molecular Weight369.64 g/mol
Exact Mass369.37
IUPAC NameN,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide
SMILESCC(=O)N(C(C)(C)CC(C)(C)NC(C)C)C(C)(C)CC(C)(C)NC(C)C
InChIInChI=1S/C22H47N3O/c1-16(2)23-19(6,7)14-21(10,11)25(18(5)26)22(12,13)15-20(8,9)24-17(3)4/h16-17,23-24H,14-15H2,1-13H3
InChIKeyCEJIYDHYGUDOQC-UHFFFAOYSA-N
XLogP4.73
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.64
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,3,5-trimethyl-5-(propan-2-ylamino)hexan-2-one
CID 164974261
2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine
CID 170208010
3,3,5-trimethyl-5-(propan-2-ylamino)heptan-2-one
CID 166964420
2-[acetyl(ethyl)amino]-N-methylpropanamide
CID 58672021
4-[(4-hydroxy-4-methylpentan-2-yl)amino]-2,4-dimethylpentan-2-ol
CID 144530358
4-(diethylamino)-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64726179
4-[ethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanoic acid
CID 64727241
N-tert-butyl-2-[5-methyl-5-(propan-2-ylamino)hexan-2-yl]oxyacetamide
CID 167107053
N-(4,4-dimethylpentan-2-yl)-N-hydroxyacetamide
CID 167231846
N-[(2S)-3,3-dimethylbutan-2-yl]-N-ethylacetamide
CID 126737316
2-methyl-N,N-bis(2,4,4-trimethylpentan-2-yl)prop-2-enamide
CID 87205211
N-(2,4-dimethyl-5-oxohexan-2-yl)acetamide
CID 153336695

Frequently Asked Questions

What is the IUPAC name of N,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide?
The IUPAC name of N,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide (CID 155175016) is N,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide.
What is the SMILES notation for N,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide?
The canonical SMILES for N,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide is CC(=O)N(C(C)(C)CC(C)(C)NC(C)C)C(C)(C)CC(C)(C)NC(C)C.
What is the InChIKey of N,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide?
The InChIKey is CEJIYDHYGUDOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H47N3O/c1-16(2)23-19(6,7)14-21(10,11)25(18(5)26)22(12,13)15-20(8,9)24-17(3)4/h16-17,23-24H,14-15H2,1-13H3.
What are the key properties of N,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide?
N,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide has a molecular weight of 369.64 g/mol, XLogP of 4.73, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis[2,4-dimethyl-4-(propan-2-ylamino)pentan-2-yl]acetamide is sourced from PubChem (CID 155175016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).