N,N,2,2-tetramethylpentan-3-amine

C9H21N — CID 129093692

IUPACN,N,2,2-tetramethylpentan-3-amine
SMILESCCC(N(C)C)C(C)(C)C
InChIInChI=1S/C9H21N/c1-7-8(10(5)6)9(2,3)4/h8H,7H2,1-6H3
InChIKeyFHGYVWKJEXUNRC-UHFFFAOYSA-N
MW143.27 g/mol
LogP2.37
Rot. Bonds2

About N,N,2,2-tetramethylpentan-3-amine

N,N,2,2-tetramethylpentan-3-amine (PubChem CID 129093692) has the molecular formula C9H21N and a molecular weight of 143.27 g/mol. Its IUPAC name is N,N,2,2-tetramethylpentan-3-amine.

Molecular Properties

Compound NameN,N,2,2-tetramethylpentan-3-amine
PubChem CID129093692
Molecular FormulaC9H21N
Molecular Weight143.27 g/mol
Exact Mass143.17
IUPAC NameN,N,2,2-tetramethylpentan-3-amine
SMILESCCC(N(C)C)C(C)(C)C
InChIInChI=1S/C9H21N/c1-7-8(10(5)6)9(2,3)4/h8H,7H2,1-6H3
InChIKeyFHGYVWKJEXUNRC-UHFFFAOYSA-N
XLogP2.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.27
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N,2,2-tetramethylpentan-3-amine?
The IUPAC name of N,N,2,2-tetramethylpentan-3-amine (CID 129093692) is N,N,2,2-tetramethylpentan-3-amine.
What is the SMILES notation for N,N,2,2-tetramethylpentan-3-amine?
The canonical SMILES for N,N,2,2-tetramethylpentan-3-amine is CCC(N(C)C)C(C)(C)C.
What is the InChIKey of N,N,2,2-tetramethylpentan-3-amine?
The InChIKey is FHGYVWKJEXUNRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N/c1-7-8(10(5)6)9(2,3)4/h8H,7H2,1-6H3.
What are the key properties of N,N,2,2-tetramethylpentan-3-amine?
N,N,2,2-tetramethylpentan-3-amine has a molecular weight of 143.27 g/mol, XLogP of 2.37, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2,2-tetramethylpentan-3-amine is sourced from PubChem (CID 129093692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).