N-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine

C7H14N2 — CID 163638318

IUPACN-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine
SMILESC=NN1C(C)CC[C@H]1C
InChIInChI=1S/C7H14N2/c1-6-4-5-7(2)9(6)8-3/h6-7H,3-5H2,1-2H3/t6-,7?/m1/s1
InChIKeyICCCMWMRQQSFGW-ULUSZKPHSA-N
MW126.20 g/mol
LogP1.47
Rot. Bonds1

About N-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine

N-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine (PubChem CID 163638318) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is N-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine.

Molecular Properties

Compound NameN-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine
PubChem CID163638318
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC NameN-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine
SMILESC=NN1C(C)CC[C@H]1C
InChIInChI=1S/C7H14N2/c1-6-4-5-7(2)9(6)8-3/h6-7H,3-5H2,1-2H3/t6-,7?/m1/s1
InChIKeyICCCMWMRQQSFGW-ULUSZKPHSA-N
XLogP1.47
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine?
The IUPAC name of N-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine (CID 163638318) is N-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine.
What is the SMILES notation for N-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine?
The canonical SMILES for N-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine is C=NN1C(C)CC[C@H]1C.
What is the InChIKey of N-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine?
The InChIKey is ICCCMWMRQQSFGW-ULUSZKPHSA-N. The full InChI is InChI=1S/C7H14N2/c1-6-4-5-7(2)9(6)8-3/h6-7H,3-5H2,1-2H3/t6-,7?/m1/s1.
What are the key properties of N-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine?
N-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine has a molecular weight of 126.20 g/mol, XLogP of 1.47, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2,5-dimethylpyrrolidin-1-yl]methanimine is sourced from PubChem (CID 163638318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).