N-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine

C11H21N5 — CID 107052904

IUPACN-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine
SMILESCCCC(CNC1CC1)Cc1nnn(C)n1
InChIInChI=1S/C11H21N5/c1-3-4-9(8-12-10-5-6-10)7-11-13-15-16(2)14-11/h9-10,12H,3-8H2,1-2H3
InChIKeyDSMGNXLXCBPDMK-UHFFFAOYSA-N
MW223.32 g/mol
LogP0.92
Rot. Bonds7

About N-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine

N-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine (PubChem CID 107052904) has the molecular formula C11H21N5 and a molecular weight of 223.32 g/mol. Its IUPAC name is N-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine
PubChem CID107052904
Molecular FormulaC11H21N5
Molecular Weight223.32 g/mol
Exact Mass223.18
IUPAC NameN-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine
SMILESCCCC(CNC1CC1)Cc1nnn(C)n1
InChIInChI=1S/C11H21N5/c1-3-4-9(8-12-10-5-6-10)7-11-13-15-16(2)14-11/h9-10,12H,3-8H2,1-2H3
InChIKeyDSMGNXLXCBPDMK-UHFFFAOYSA-N
XLogP0.92
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-tert-butyl-2-[(2-methyltetrazol-5-yl)methyl]pentan-1-amine
CID 107052906
4-chloro-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine
CID 107054011
2-[(2-methyltetrazol-5-yl)methyl]-N-propylbutan-1-amine
CID 107052925
N-[2-[(1-propan-2-ylpyrazol-3-yl)methyl]pentyl]cyclopropanamine
CID 64773206
N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine
CID 103014322
N-[2-[(1-cyclopentylpyrazol-3-yl)methyl]pentyl]cyclopropanamine
CID 64779466
N-[2-(2-methoxyethyl)pentyl]cyclopropanamine
CID 62528132
1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107049334
N-[2,3-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]butyl]cyclopropanamine
CID 107053558
[1-(3-ethylcyclohexyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066163
1-cyclohexyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107048433
2-cyclopentyl-N-(2-methoxyethyl)-3-(2-methyltetrazol-5-yl)propan-1-amine
CID 107053577

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine?
The IUPAC name of N-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine (CID 107052904) is N-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine.
What is the SMILES notation for N-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine?
The canonical SMILES for N-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine is CCCC(CNC1CC1)Cc1nnn(C)n1.
What is the InChIKey of N-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine?
The InChIKey is DSMGNXLXCBPDMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5/c1-3-4-9(8-12-10-5-6-10)7-11-13-15-16(2)14-11/h9-10,12H,3-8H2,1-2H3.
What are the key properties of N-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine?
N-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine has a molecular weight of 223.32 g/mol, XLogP of 0.92, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-methyltetrazol-5-yl)methyl]pentyl]cyclopropanamine is sourced from PubChem (CID 107052904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).