5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine

C14H24N4 — CID 105420972

IUPAC5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine
SMILESCNc1cncc(N(C)CC2(N(C)C)CCC2)c1
InChIInChI=1S/C14H24N4/c1-15-12-8-13(10-16-9-12)18(4)11-14(17(2)3)6-5-7-14/h8-10,15H,5-7,11H2,1-4H3
InChIKeyOINZWAAHUGIQIZ-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.04
Rot. Bonds5

About 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine

5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine (PubChem CID 105420972) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine.

Molecular Properties

Compound Name5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine
PubChem CID105420972
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine
SMILESCNc1cncc(N(C)CC2(N(C)C)CCC2)c1
InChIInChI=1S/C14H24N4/c1-15-12-8-13(10-16-9-12)18(4)11-14(17(2)3)6-5-7-14/h8-10,15H,5-7,11H2,1-4H3
InChIKeyOINZWAAHUGIQIZ-UHFFFAOYSA-N
XLogP2.04
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine?
The IUPAC name of 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine (CID 105420972) is 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine.
What is the SMILES notation for 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine?
The canonical SMILES for 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine is CNc1cncc(N(C)CC2(N(C)C)CCC2)c1.
What is the InChIKey of 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine?
The InChIKey is OINZWAAHUGIQIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-15-12-8-13(10-16-9-12)18(4)11-14(17(2)3)6-5-7-14/h8-10,15H,5-7,11H2,1-4H3.
What are the key properties of 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine?
5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine has a molecular weight of 248.37 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,5-N-dimethylpyridine-3,5-diamine is sourced from PubChem (CID 105420972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).