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

C7H16N2 — CID 129045420

IUPAC1-methyl-N-propan-2-ylazetidin-3-amine
SMILESCC(C)NC1CN(C)C1
InChIInChI=1S/C7H16N2/c1-6(2)8-7-4-9(3)5-7/h6-8H,4-5H2,1-3H3
InChIKeyVLJSTSPPYGWWRF-UHFFFAOYSA-N
MW128.22 g/mol
LogP0.30
Rot. Bonds2

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

1-methyl-N-propan-2-ylazetidin-3-amine (PubChem CID 129045420) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is 1-methyl-N-propan-2-ylazetidin-3-amine.

Molecular Properties

Compound Name1-methyl-N-propan-2-ylazetidin-3-amine
PubChem CID129045420
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC Name1-methyl-N-propan-2-ylazetidin-3-amine
SMILESCC(C)NC1CN(C)C1
InChIInChI=1S/C7H16N2/c1-6(2)8-7-4-9(3)5-7/h6-8H,4-5H2,1-3H3
InChIKeyVLJSTSPPYGWWRF-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

ethane;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-N-propan-2-ylpyrrolidin-3-amine;molecular hydrogen
CID 142350050
1-tert-butyl-N-propan-2-ylazetidin-3-amine
CID 130287809
1-(3-methylbutyl)-N-propan-2-ylpiperidin-4-amine
CID 164928841
1-N,3-N,5-N-tri(propan-2-yl)cyclohexane-1,3,5-triamine
CID 101492125
1-methylsulfonyl-N-propan-2-ylazetidin-3-amine
CID 130416289
(3R,4R)-4-methoxy-1-methyl-N-propan-2-ylpyrrolidin-3-amine
CID 122696201
7-methyl-N-propan-2-yl-3-oxa-7-azabicyclo[3.3.1]nonan-9-amine
CID 174360435
N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide
CID 164713767
N-propan-2-ylcycloheptanamine
CID 42562651
(3S)-1-(2-methylpropyl)-N-propan-2-ylpyrrolidin-3-amine
CID 164836687
4-(4-methylpiperazin-1-yl)-N-propan-2-ylcyclohexan-1-amine
CID 67476033
(3S)-N,1-di(propan-2-yl)pyrrolidin-3-amine
CID 94057880

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-propan-2-ylazetidin-3-amine?
The IUPAC name of 1-methyl-N-propan-2-ylazetidin-3-amine (CID 129045420) is 1-methyl-N-propan-2-ylazetidin-3-amine.
What is the SMILES notation for 1-methyl-N-propan-2-ylazetidin-3-amine?
The canonical SMILES for 1-methyl-N-propan-2-ylazetidin-3-amine is CC(C)NC1CN(C)C1.
What is the InChIKey of 1-methyl-N-propan-2-ylazetidin-3-amine?
The InChIKey is VLJSTSPPYGWWRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2/c1-6(2)8-7-4-9(3)5-7/h6-8H,4-5H2,1-3H3.
What are the key properties of 1-methyl-N-propan-2-ylazetidin-3-amine?
1-methyl-N-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 1-methyl-N-propan-2-ylazetidin-3-amine is sourced from PubChem (CID 129045420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).