tricyclo[3.3.1.03,7]nonane-1,9-diamine

C9H16N2 — CID 130804246

IUPACtricyclo[3.3.1.03,7]nonane-1,9-diamine
SMILESNC1C2CC3CC1(N)CC3C2
InChIInChI=1S/C9H16N2/c10-8-5-1-6-3-9(8,11)4-7(6)2-5/h5-8H,1-4,10-11H2
InChIKeyBCOPDKBGSLJNJK-UHFFFAOYSA-N
MW152.24 g/mol
LogP0.46
Rot. Bonds

About tricyclo[3.3.1.03,7]nonane-1,9-diamine

tricyclo[3.3.1.03,7]nonane-1,9-diamine (PubChem CID 130804246) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is tricyclo[3.3.1.03,7]nonane-1,9-diamine.

Molecular Properties

Compound Nametricyclo[3.3.1.03,7]nonane-1,9-diamine
PubChem CID130804246
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Nametricyclo[3.3.1.03,7]nonane-1,9-diamine
SMILESNC1C2CC3CC1(N)CC3C2
InChIInChI=1S/C9H16N2/c10-8-5-1-6-3-9(8,11)4-7(6)2-5/h5-8H,1-4,10-11H2
InChIKeyBCOPDKBGSLJNJK-UHFFFAOYSA-N
XLogP0.46
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methylbicyclo[1.1.1]pentan-1-amine
CID 123370149
5,5-difluoro-2,3,3a,4,6,6a-hexahydro-1H-pentalen-2-amine
CID 105431578
(1R,8S)-tetracyclo[4.3.1.02,4.03,8]decan-6-amine
CID 57338028
7-methyltricyclo[3.3.1.03,9]nonan-7-amine
CID 152844256
3-(1,2-thiazol-4-yl)bicyclo[3.1.0]hexan-3-amine
CID 82408720
(1R,2S,4R,5S)-bicyclo[2.2.1]heptane-2,5-diamine
CID 11423598
bicyclo[2.2.1]heptane-2,5-diamine
CID 4169642
7-methyl-7-azatricyclo[3.3.1.03,9]nonan-3-amine
CID 123304535
bicyclo[2.2.1]heptane-1,2-diamine;platinum
CID 88686681
tricyclo[4.3.1.12,5]undecan-1-amine
CID 18965986
1-methylcyclopropane-1,2-diamine
CID 15182447
cyclobutane-1,1,3-triamine
CID 59409075

Frequently Asked Questions

What is the IUPAC name of tricyclo[3.3.1.03,7]nonane-1,9-diamine?
The IUPAC name of tricyclo[3.3.1.03,7]nonane-1,9-diamine (CID 130804246) is tricyclo[3.3.1.03,7]nonane-1,9-diamine.
What is the SMILES notation for tricyclo[3.3.1.03,7]nonane-1,9-diamine?
The canonical SMILES for tricyclo[3.3.1.03,7]nonane-1,9-diamine is NC1C2CC3CC1(N)CC3C2.
What is the InChIKey of tricyclo[3.3.1.03,7]nonane-1,9-diamine?
The InChIKey is BCOPDKBGSLJNJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c10-8-5-1-6-3-9(8,11)4-7(6)2-5/h5-8H,1-4,10-11H2.
What are the key properties of tricyclo[3.3.1.03,7]nonane-1,9-diamine?
tricyclo[3.3.1.03,7]nonane-1,9-diamine has a molecular weight of 152.24 g/mol, XLogP of 0.46, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tricyclo[3.3.1.03,7]nonane-1,9-diamine is sourced from PubChem (CID 130804246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).