2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine

C11H17N3 — CID 81131613

IUPAC2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine
SMILESCc1ccc(N)c(N(C)CC2CC2)n1
InChIInChI=1S/C11H17N3/c1-8-3-6-10(12)11(13-8)14(2)7-9-4-5-9/h3,6,9H,4-5,7,12H2,1-2H3
InChIKeyDODVTZOFLIXGFQ-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.82
Rot. Bonds3

About 2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine

2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine (PubChem CID 81131613) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine
PubChem CID81131613
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine
SMILESCc1ccc(N)c(N(C)CC2CC2)n1
InChIInChI=1S/C11H17N3/c1-8-3-6-10(12)11(13-8)14(2)7-9-4-5-9/h3,6,9H,4-5,7,12H2,1-2H3
InChIKeyDODVTZOFLIXGFQ-UHFFFAOYSA-N
XLogP1.82
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[(3-amino-6-methyl-2-pyridinyl)-methylamino]methyl]cyclobutan-1-ol
CID 81133179
2-N,6-dimethyl-2-N-(oxan-3-ylmethyl)pyridine-2,3-diamine
CID 81131398
2-N,6-dimethyl-2-N-propylpyridine-2,3-diamine
CID 81133237
2-N-benzyl-2-N,6-dimethylpyridine-2,3-diamine
CID 79020868
1-[(3-amino-6-methyl-2-pyridinyl)-methylamino]-2-methylpropan-2-ol
CID 81131762
4-N-(cyclopropylmethyl)-4-N,2,5-trimethylpyrimidine-4,6-diamine
CID 80798139
2-[(3-amino-6-methyl-2-pyridinyl)-methylamino]-N,N-dimethylacetamide
CID 81132413
2-N-(4,4-dimethylcyclohexyl)-2-N,6-dimethylpyridine-2,3-diamine
CID 81131881
2-N-cyclopropyl-6-methyl-2-N-propylpyridine-2,3-diamine
CID 81133120
2-N,6-dimethyl-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine
CID 81131626
2-[(3-amino-6-methyl-2-pyridinyl)-methylamino]-N-methylacetamide
CID 81132412
6-chloro-2-N,2-N-bis(cyclopropylmethyl)pyridine-2,3-diamine
CID 115474204

Frequently Asked Questions

What is the IUPAC name of 2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine?
The IUPAC name of 2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine (CID 81131613) is 2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine.
What is the SMILES notation for 2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine?
The canonical SMILES for 2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine is Cc1ccc(N)c(N(C)CC2CC2)n1.
What is the InChIKey of 2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine?
The InChIKey is DODVTZOFLIXGFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-8-3-6-10(12)11(13-8)14(2)7-9-4-5-9/h3,6,9H,4-5,7,12H2,1-2H3.
What are the key properties of 2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine?
2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine has a molecular weight of 191.28 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(cyclopropylmethyl)-2-N,6-dimethylpyridine-2,3-diamine is sourced from PubChem (CID 81131613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).