(1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine

C7H15N3 — CID 129230384

IUPAC(1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine
SMILESCN1C[C@H]2C[C@H](N)[C@@H]1[C@@H]2N
InChIInChI=1S/C7H15N3/c1-10-3-4-2-5(8)7(10)6(4)9/h4-7H,2-3,8-9H2,1H3/t4-,5+,6-,7-/m1/s1
InChIKeyPYZAMQNPYVVOHM-XZBKPIIZSA-N
MW141.22 g/mol
LogP-1.03
Rot. Bonds

About (1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine

(1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine (PubChem CID 129230384) has the molecular formula C7H15N3 and a molecular weight of 141.22 g/mol. Its IUPAC name is (1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine.

Molecular Properties

Compound Name(1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine
PubChem CID129230384
Molecular FormulaC7H15N3
Molecular Weight141.22 g/mol
Exact Mass141.13
IUPAC Name(1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine
SMILESCN1C[C@H]2C[C@H](N)[C@@H]1[C@@H]2N
InChIInChI=1S/C7H15N3/c1-10-3-4-2-5(8)7(10)6(4)9/h4-7H,2-3,8-9H2,1H3/t4-,5+,6-,7-/m1/s1
InChIKeyPYZAMQNPYVVOHM-XZBKPIIZSA-N
XLogP-1.03
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.22
LogP ≤ 5-1.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine with MolForge

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Related Compounds

(1R,4R,6S,7R)-2-butyl-2-azabicyclo[2.2.1]heptane-6,7-diamine
CID 167260013
9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol
CID 115013780
dimethyl-[(1R,6S)-2-methyl-2-azabicyclo[2.2.0]hexan-6-yl]silane
CID 174102898
(1R,4R,7R)-2-N,6-dimethyl-2-azabicyclo[2.2.1]heptane-2,7-diamine
CID 167135042
1,6-dimethylpiperidine-3,4-diamine
CID 82417846
2-(1-methylpiperidin-4-yl)-1-azabicyclo[2.2.2]octan-3-amine
CID 115034186
(8S)-3-methyl-3-azatricyclo[3.3.0.02,8]octane
CID 130224123
(2S,4S,5S)-1,2,5-trimethylpiperidin-4-amine
CID 98195230
2-(1,5-dimethylpyrrolidin-3-yl)-2-azabicyclo[2.1.1]hexan-5-amine
CID 130961406
bicyclo[2.2.1]heptane-2,5-diamine
CID 4169642
(1R,2S,4R,5S)-bicyclo[2.2.1]heptane-2,5-diamine
CID 11423598
(1S,2R,5R)-2,3-dimethyl-3-azabicyclo[3.1.0]hexane
CID 59917347

Frequently Asked Questions

What is the IUPAC name of (1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine?
The IUPAC name of (1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine (CID 129230384) is (1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine.
What is the SMILES notation for (1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine?
The canonical SMILES for (1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine is CN1C[C@H]2C[C@H](N)[C@@H]1[C@@H]2N.
What is the InChIKey of (1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine?
The InChIKey is PYZAMQNPYVVOHM-XZBKPIIZSA-N. The full InChI is InChI=1S/C7H15N3/c1-10-3-4-2-5(8)7(10)6(4)9/h4-7H,2-3,8-9H2,1H3/t4-,5+,6-,7-/m1/s1.
What are the key properties of (1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine?
(1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine has a molecular weight of 141.22 g/mol, XLogP of -1.03, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine is sourced from PubChem (CID 129230384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).