4-(1-methyltetrazol-5-yl)cyclononan-1-amine

C11H21N5 — CID 155228736

IUPAC4-(1-methyltetrazol-5-yl)cyclononan-1-amine
SMILESCn1nnnc1C1CCCCCC(N)CC1
InChIInChI=1S/C11H21N5/c1-16-11(13-14-15-16)9-5-3-2-4-6-10(12)8-7-9/h9-10H,2-8,12H2,1H3
InChIKeyRZUYIYXMBRIQSR-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.37
Rot. Bonds1

About 4-(1-methyltetrazol-5-yl)cyclononan-1-amine

4-(1-methyltetrazol-5-yl)cyclononan-1-amine (PubChem CID 155228736) has the molecular formula C11H21N5 and a molecular weight of 223.32 g/mol. Its IUPAC name is 4-(1-methyltetrazol-5-yl)cyclononan-1-amine.

Molecular Properties

Compound Name4-(1-methyltetrazol-5-yl)cyclononan-1-amine
PubChem CID155228736
Molecular FormulaC11H21N5
Molecular Weight223.32 g/mol
Exact Mass223.18
IUPAC Name4-(1-methyltetrazol-5-yl)cyclononan-1-amine
SMILESCn1nnnc1C1CCCCCC(N)CC1
InChIInChI=1S/C11H21N5/c1-16-11(13-14-15-16)9-5-3-2-4-6-10(12)8-7-9/h9-10H,2-8,12H2,1H3
InChIKeyRZUYIYXMBRIQSR-UHFFFAOYSA-N
XLogP1.37
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(1-methyltetrazol-5-yl)cyclononan-1-amine?
The IUPAC name of 4-(1-methyltetrazol-5-yl)cyclononan-1-amine (CID 155228736) is 4-(1-methyltetrazol-5-yl)cyclononan-1-amine.
What is the SMILES notation for 4-(1-methyltetrazol-5-yl)cyclononan-1-amine?
The canonical SMILES for 4-(1-methyltetrazol-5-yl)cyclononan-1-amine is Cn1nnnc1C1CCCCCC(N)CC1.
What is the InChIKey of 4-(1-methyltetrazol-5-yl)cyclononan-1-amine?
The InChIKey is RZUYIYXMBRIQSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5/c1-16-11(13-14-15-16)9-5-3-2-4-6-10(12)8-7-9/h9-10H,2-8,12H2,1H3.
What are the key properties of 4-(1-methyltetrazol-5-yl)cyclononan-1-amine?
4-(1-methyltetrazol-5-yl)cyclononan-1-amine has a molecular weight of 223.32 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methyltetrazol-5-yl)cyclononan-1-amine is sourced from PubChem (CID 155228736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).