1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine

C15H21N5 — CID 107417869

IUPAC1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine
SMILESCC1CCCC1CNCc1nnnn1-c1ccccc1
InChIInChI=1S/C15H21N5/c1-12-6-5-7-13(12)10-16-11-15-17-18-19-20(15)14-8-3-2-4-9-14/h2-4,8-9,12-13,16H,5-7,10-11H2,1H3
InChIKeyQHAZEGYBRGNUCC-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.19
Rot. Bonds5

About 1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine

1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine (PubChem CID 107417869) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine
PubChem CID107417869
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine
SMILESCC1CCCC1CNCc1nnnn1-c1ccccc1
InChIInChI=1S/C15H21N5/c1-12-6-5-7-13(12)10-16-11-15-17-18-19-20(15)14-8-3-2-4-9-14/h2-4,8-9,12-13,16H,5-7,10-11H2,1H3
InChIKeyQHAZEGYBRGNUCC-UHFFFAOYSA-N
XLogP2.19
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-methylcyclohexyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine
CID 63243666
N-[(1-phenyltetrazol-5-yl)methyl]ethanamine
CID 3031920
N'-cyclopropyl-N'-methyl-N-[(1-phenyltetrazol-5-yl)methyl]ethane-1,2-diamine
CID 62977216
N-[(1-phenyltetrazol-5-yl)methyl]ethanamine;hydrochloride
CID 3031919
4-methyl-N-[(1-phenyltetrazol-5-yl)methyl]cyclohexan-1-amine
CID 60672744
N-[(1-phenyltetrazol-5-yl)methyl]cyclooctanamine
CID 60673062
1-[[(1-phenyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol
CID 65108941
N-[(1-phenyltetrazol-5-yl)methyl]-1-[(2S)-1-pyridazin-3-ylpyrrolidin-2-yl]methanamine
CID 95329826
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(1-phenyltetrazol-5-yl)methanamine
CID 106372826
1,1-dicyclopropyl-N-[(1-phenyltetrazol-5-yl)methyl]methanamine
CID 60714049
2-[[(1-phenyltetrazol-5-yl)methylamino]methyl]phenol
CID 115603162
2-methyl-N-[(1-phenyltetrazol-5-yl)methyl]butan-1-amine
CID 55108359

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine?
The IUPAC name of 1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine (CID 107417869) is 1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine.
What is the SMILES notation for 1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine?
The canonical SMILES for 1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine is CC1CCCC1CNCc1nnnn1-c1ccccc1.
What is the InChIKey of 1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine?
The InChIKey is QHAZEGYBRGNUCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-12-6-5-7-13(12)10-16-11-15-17-18-19-20(15)14-8-3-2-4-9-14/h2-4,8-9,12-13,16H,5-7,10-11H2,1H3.
What are the key properties of 1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine?
1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine has a molecular weight of 271.37 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclopentyl)-N-[(1-phenyltetrazol-5-yl)methyl]methanamine is sourced from PubChem (CID 107417869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).