N-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine

C14H25N3 — CID 164926851

IUPACN-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine
SMILESCC(C)c1cccc(N2CCCC2)n1.CNC
InChIInChI=1S/C12H18N2.C2H7N/c1-10(2)11-6-5-7-12(13-11)14-8-3-4-9-14;1-3-2/h5-7,10H,3-4,8-9H2,1-2H3;3H,1-2H3
InChIKeyCKQPVDGGCLWTGZ-UHFFFAOYSA-N
MW235.38 g/mol
LogP2.64
Rot. Bonds2

About N-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine

N-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine (PubChem CID 164926851) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is N-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine.

Molecular Properties

Compound NameN-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine
PubChem CID164926851
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC NameN-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine
SMILESCC(C)c1cccc(N2CCCC2)n1.CNC
InChIInChI=1S/C12H18N2.C2H7N/c1-10(2)11-6-5-7-12(13-11)14-8-3-4-9-14;1-3-2/h5-7,10H,3-4,8-9H2,1-2H3;3H,1-2H3
InChIKeyCKQPVDGGCLWTGZ-UHFFFAOYSA-N
XLogP2.64
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine?
The IUPAC name of N-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine (CID 164926851) is N-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine.
What is the SMILES notation for N-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine?
The canonical SMILES for N-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine is CC(C)c1cccc(N2CCCC2)n1.CNC.
What is the InChIKey of N-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine?
The InChIKey is CKQPVDGGCLWTGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2.C2H7N/c1-10(2)11-6-5-7-12(13-11)14-8-3-4-9-14;1-3-2/h5-7,10H,3-4,8-9H2,1-2H3;3H,1-2H3.
What are the key properties of N-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine?
N-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine has a molecular weight of 235.38 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylmethanamine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine is sourced from PubChem (CID 164926851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).