(2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine

C9H20N2 — CID 130547403

IUPAC(2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine
SMILESCC(C)C[C@@H](N)CN1CCC1
InChIInChI=1S/C9H20N2/c1-8(2)6-9(10)7-11-4-3-5-11/h8-9H,3-7,10H2,1-2H3/t9-/m1/s1
InChIKeyDFHJTSKEVWXCHF-SECBINFHSA-N
MW156.27 g/mol
LogP1.07
Rot. Bonds4

About (2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine

(2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine (PubChem CID 130547403) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is (2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine.

Molecular Properties

Compound Name(2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine
PubChem CID130547403
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name(2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine
SMILESCC(C)C[C@@H](N)CN1CCC1
InChIInChI=1S/C9H20N2/c1-8(2)6-9(10)7-11-4-3-5-11/h8-9H,3-7,10H2,1-2H3/t9-/m1/s1
InChIKeyDFHJTSKEVWXCHF-SECBINFHSA-N
XLogP1.07
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-4-methyl-1-morpholin-4-ylpentan-2-amine
CID 18649577
4-methyl-1-(4-methylsulfonylpiperazin-1-yl)pentan-2-amine
CID 63004932
4-methyl-1-(3,3,4-trimethylpiperazin-1-yl)pentan-2-amine
CID 63621588
4-methyl-1-(3-methylpyrrolidin-1-yl)pentan-2-amine
CID 61225825
1-(3,4,6,7,8,8a-hexahydro-2H-pyrrolo[1,2-a]pyrimidin-1-yl)-4-methylpentan-2-amine
CID 3378337
1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine
CID 159983719
azane;1-(2-methylpropyl)pyrrolidine
CID 122583370
1-piperidin-1-ylpentan-2-amine
CID 43650435
4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine
CID 61471885
1-(2-ethylpyrrolidin-1-yl)-4-methylpentan-2-amine
CID 60973405
4,4-dimethyl-1-piperidin-1-ylpentan-2-amine
CID 117241671
1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-4-methylpentan-2-amine
CID 102726819

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine?
The IUPAC name of (2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine (CID 130547403) is (2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine.
What is the SMILES notation for (2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine?
The canonical SMILES for (2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine is CC(C)C[C@@H](N)CN1CCC1.
What is the InChIKey of (2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine?
The InChIKey is DFHJTSKEVWXCHF-SECBINFHSA-N. The full InChI is InChI=1S/C9H20N2/c1-8(2)6-9(10)7-11-4-3-5-11/h8-9H,3-7,10H2,1-2H3/t9-/m1/s1.
What are the key properties of (2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine?
(2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine has a molecular weight of 156.27 g/mol, XLogP of 1.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(azetidin-1-yl)-4-methylpentan-2-amine is sourced from PubChem (CID 130547403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).