N,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine

C18H40N2O — CID 159310191

IUPACN,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine
SMILESCC(C)C(=O)N(C)C(C)C.CC(C)N(C)C(C)(C)C(C)C
InChIInChI=1S/C10H23N.C8H17NO/c1-8(2)10(5,6)11(7)9(3)4;1-6(2)8(10)9(5)7(3)4/h8-9H,1-7H3;6-7H,1-5H3
InChIKeyLCKZBZYMBYSBML-UHFFFAOYSA-N
MW300.53 g/mol
LogP4.27
Rot. Bonds5

About N,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine

N,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine (PubChem CID 159310191) has the molecular formula C18H40N2O and a molecular weight of 300.53 g/mol. Its IUPAC name is N,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine
PubChem CID159310191
Molecular FormulaC18H40N2O
Molecular Weight300.53 g/mol
Exact Mass300.31
IUPAC NameN,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine
SMILESCC(C)C(=O)N(C)C(C)C.CC(C)N(C)C(C)(C)C(C)C
InChIInChI=1S/C10H23N.C8H17NO/c1-8(2)10(5,6)11(7)9(3)4;1-6(2)8(10)9(5)7(3)4/h8-9H,1-7H3;6-7H,1-5H3
InChIKeyLCKZBZYMBYSBML-UHFFFAOYSA-N
XLogP4.27
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.53
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine?
The IUPAC name of N,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine (CID 159310191) is N,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine.
What is the SMILES notation for N,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine?
The canonical SMILES for N,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine is CC(C)C(=O)N(C)C(C)C.CC(C)N(C)C(C)(C)C(C)C.
What is the InChIKey of N,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine?
The InChIKey is LCKZBZYMBYSBML-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N.C8H17NO/c1-8(2)10(5,6)11(7)9(3)4;1-6(2)8(10)9(5)7(3)4/h8-9H,1-7H3;6-7H,1-5H3.
What are the key properties of N,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine?
N,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine has a molecular weight of 300.53 g/mol, XLogP of 4.27, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-propan-2-ylpropanamide;N,2,3-trimethyl-N-propan-2-ylbutan-2-amine is sourced from PubChem (CID 159310191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).