N-methyl-1-propan-2-ylazetidin-3-amine

C7H16N2 — CID 22952913

IUPACN-methyl-1-propan-2-ylazetidin-3-amine
SMILESCNC1CN(C(C)C)C1
InChIInChI=1S/C7H16N2/c1-6(2)9-4-7(5-9)8-3/h6-8H,4-5H2,1-3H3
InChIKeyMVQNWPCNVVIJQW-UHFFFAOYSA-N
MW128.22 g/mol
LogP0.30
Rot. Bonds2

About N-methyl-1-propan-2-ylazetidin-3-amine

N-methyl-1-propan-2-ylazetidin-3-amine (PubChem CID 22952913) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is N-methyl-1-propan-2-ylazetidin-3-amine.

Molecular Properties

Compound NameN-methyl-1-propan-2-ylazetidin-3-amine
PubChem CID22952913
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC NameN-methyl-1-propan-2-ylazetidin-3-amine
SMILESCNC1CN(C(C)C)C1
InChIInChI=1S/C7H16N2/c1-6(2)9-4-7(5-9)8-3/h6-8H,4-5H2,1-3H3
InChIKeyMVQNWPCNVVIJQW-UHFFFAOYSA-N
XLogP0.30
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-N-methyl-1-propan-2-ylpyrrolidin-3-amine
CID 55299463
(3R)-N,6-dimethyl-1-propan-2-ylazepan-3-amine
CID 174295591
(3R,5R)-5-(methylamino)-1-propan-2-ylpiperidin-3-ol
CID 129237445
N-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen
CID 177033452
1-butan-2-yl-N-methylazetidin-3-amine
CID 117002866
N-(2-methylpropyl)-1-propan-2-ylazetidin-3-amine
CID 155088141
(3R,4S)-4-fluoro-N-methyl-1-propan-2-ylpyrrolidin-3-amine
CID 177078816
(3S,4S)-4-fluoro-N-methyl-1-propan-2-ylpyrrolidin-3-amine
CID 167501461
amino-[3-(methylamino)azetidin-1-yl]methanol
CID 171532513
2-[5-(methylamino)-1-propan-2-ylpiperidin-3-yl]acetic acid
CID 83989664
(1-propan-2-ylazetidin-3-yl)urea
CID 130678981
3,4-dimethyl-1-propan-2-ylpyrrolidine
CID 20737893

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-propan-2-ylazetidin-3-amine?
The IUPAC name of N-methyl-1-propan-2-ylazetidin-3-amine (CID 22952913) is N-methyl-1-propan-2-ylazetidin-3-amine.
What is the SMILES notation for N-methyl-1-propan-2-ylazetidin-3-amine?
The canonical SMILES for N-methyl-1-propan-2-ylazetidin-3-amine is CNC1CN(C(C)C)C1.
What is the InChIKey of N-methyl-1-propan-2-ylazetidin-3-amine?
The InChIKey is MVQNWPCNVVIJQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2/c1-6(2)9-4-7(5-9)8-3/h6-8H,4-5H2,1-3H3.
What are the key properties of N-methyl-1-propan-2-ylazetidin-3-amine?
N-methyl-1-propan-2-ylazetidin-3-amine has a molecular weight of 128.22 g/mol, XLogP of 0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-propan-2-ylazetidin-3-amine is sourced from PubChem (CID 22952913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).