N-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine

C11H23N5 — CID 107049227

IUPACN-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine
SMILESCCNC(Cc1nnn(C)n1)CC(C)(C)C
InChIInChI=1S/C11H23N5/c1-6-12-9(8-11(2,3)4)7-10-13-15-16(5)14-10/h9,12H,6-8H2,1-5H3
InChIKeyDYXHDGTWHKJLHP-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.17
Rot. Bonds5

About N-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine

N-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine (PubChem CID 107049227) has the molecular formula C11H23N5 and a molecular weight of 225.34 g/mol. Its IUPAC name is N-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine.

Molecular Properties

Compound NameN-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine
PubChem CID107049227
Molecular FormulaC11H23N5
Molecular Weight225.34 g/mol
Exact Mass225.20
IUPAC NameN-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine
SMILESCCNC(Cc1nnn(C)n1)CC(C)(C)C
InChIInChI=1S/C11H23N5/c1-6-12-9(8-11(2,3)4)7-10-13-15-16(5)14-10/h9,12H,6-8H2,1-5H3
InChIKeyDYXHDGTWHKJLHP-UHFFFAOYSA-N
XLogP1.17
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-1-(2-methyltetrazol-5-yl)-3-pyridin-4-ylpropan-2-amine
CID 107048946
N,3-diethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine
CID 107064998
N-ethyl-1-(2-methyltetrazol-5-yl)-3-thiophen-3-ylpropan-2-amine
CID 107065100
N-ethyl-1-(2-methyltetrazol-5-yl)-3-phenoxypropan-2-amine
CID 107048963
N-ethyl-1-(4-fluorophenyl)sulfanyl-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107049659
N-ethyl-4-(4-methoxyphenyl)-1-(2-methyltetrazol-5-yl)butan-2-amine
CID 107065191
N-ethyl-1-(2-methyltetrazol-5-yl)-4-phenoxybutan-2-amine
CID 107048302
N-ethyl-3,3-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]butan-1-amine
CID 107053527
1-(2-chlorophenyl)sulfanyl-N-ethyl-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107049697
N-ethyl-1-(3-fluorophenyl)sulfanyl-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107049652
1-N,1-N-diethyl-3-N-methyl-4-(2-methyltetrazol-5-yl)butane-1,3-diamine
CID 107050035
N-ethyl-2-(2-methyltetrazol-5-yl)-1-(2H-triazol-4-yl)ethanamine
CID 107050427

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine?
The IUPAC name of N-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine (CID 107049227) is N-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine.
What is the SMILES notation for N-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine?
The canonical SMILES for N-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine is CCNC(Cc1nnn(C)n1)CC(C)(C)C.
What is the InChIKey of N-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine?
The InChIKey is DYXHDGTWHKJLHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N5/c1-6-12-9(8-11(2,3)4)7-10-13-15-16(5)14-10/h9,12H,6-8H2,1-5H3.
What are the key properties of N-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine?
N-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine has a molecular weight of 225.34 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-2-amine is sourced from PubChem (CID 107049227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).