N,2,2-trimethyl-N-propan-2-ylpropan-1-amine

C9H21N — CID 23588538

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

About N,2,2-trimethyl-N-propan-2-ylpropan-1-amine

N,2,2-trimethyl-N-propan-2-ylpropan-1-amine (PubChem CID 23588538) has the molecular formula C9H21N and a molecular weight of 143.27 g/mol. Its IUPAC name is N,2,2-trimethyl-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound NameN,2,2-trimethyl-N-propan-2-ylpropan-1-amine
PubChem CID23588538
Molecular FormulaC9H21N
Molecular Weight143.27 g/mol
Exact Mass143.17
IUPAC NameN,2,2-trimethyl-N-propan-2-ylpropan-1-amine
SMILESCC(C)N(C)CC(C)(C)C
InChIInChI=1S/C9H21N/c1-8(2)10(6)7-9(3,4)5/h8H,7H2,1-6H3
InChIKeyWLALXJXRAYVCPO-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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Related Compounds

1-[2,2-dimethylpropyl(methyl)amino]ethanol
CID 154651537
3-bromo-N,2,2-trimethyl-N-propan-2-ylpropan-1-amine
CID 65000340
N-(2,2-dimethylpropyl)-N,5,5-trimethylhexan-2-amine
CID 156542499
1-N,3-N,2,2-tetramethyl-1-N-propan-2-ylbutane-1,3-diamine
CID 66455555
N-(1-cyclopropylethyl)-N,2,2-trimethylpropan-1-amine
CID 77360899
2-ethyl-1-N-methyl-1-N-propan-2-ylbutane-1,2-diamine
CID 79814972
lithium;hydride;N,N,2,2-tetramethylpropan-1-amine
CID 174663551
2-ethyl-N,N',2-trimethyl-N'-propan-2-ylpropane-1,3-diamine
CID 62263389
(3S)-2,2-difluoro-N,3,4-trimethyl-N-propan-2-ylpentan-1-amine
CID 176932878
N,2,2-trimethyl-N'-(2-methylpropyl)-N-propan-2-ylpropane-1,3-diamine
CID 62261892
nickel;4,4,4-trifluoro-2-methyl-1-[methyl(propan-2-yl)amino]butan-2-ol
CID 169073997
4-N-(2,2-dimethylpropyl)-2-N-ethyl-4-N-methylpentane-2,4-diamine
CID 64707421

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-N-propan-2-ylpropan-1-amine?
The IUPAC name of N,2,2-trimethyl-N-propan-2-ylpropan-1-amine (CID 23588538) is N,2,2-trimethyl-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for N,2,2-trimethyl-N-propan-2-ylpropan-1-amine?
The canonical SMILES for N,2,2-trimethyl-N-propan-2-ylpropan-1-amine is CC(C)N(C)CC(C)(C)C.
What is the InChIKey of N,2,2-trimethyl-N-propan-2-ylpropan-1-amine?
The InChIKey is WLALXJXRAYVCPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N/c1-8(2)10(6)7-9(3,4)5/h8H,7H2,1-6H3.
What are the key properties of N,2,2-trimethyl-N-propan-2-ylpropan-1-amine?
N,2,2-trimethyl-N-propan-2-ylpropan-1-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,2,2-trimethyl-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 23588538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).