1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine

C10H21N5 — CID 102913752

IUPAC1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine
SMILESCC(C)C(CNc1nnnn1C)C(C)C
InChIInChI=1S/C10H21N5/c1-7(2)9(8(3)4)6-11-10-12-13-14-15(10)5/h7-9H,6H2,1-5H3,(H,11,12,14)
InChIKeyLLIWKLJRHBQVBT-UHFFFAOYSA-N
MW211.31 g/mol
LogP1.55
Rot. Bonds5

About 1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine

1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine (PubChem CID 102913752) has the molecular formula C10H21N5 and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine.

Molecular Properties

Compound Name1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine
PubChem CID102913752
Molecular FormulaC10H21N5
Molecular Weight211.31 g/mol
Exact Mass211.18
IUPAC Name1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine
SMILESCC(C)C(CNc1nnnn1C)C(C)C
InChIInChI=1S/C10H21N5/c1-7(2)9(8(3)4)6-11-10-12-13-14-15(10)5/h7-9H,6H2,1-5H3,(H,11,12,14)
InChIKeyLLIWKLJRHBQVBT-UHFFFAOYSA-N
XLogP1.55
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,2-difluoroethyl)-1-methyltetrazol-5-amine
CID 79099576
N-(2-chloro-4-methylpentyl)-1-methyltetrazol-5-amine
CID 107156271
3-methyl-2-[[(1-methyltetrazol-5-yl)amino]methyl]butanoic acid
CID 65226801
1-[(1-methyltetrazol-5-yl)amino]propane-2-sulfonamide
CID 130611826
1-cyclopropyl-N'-(1-methyltetrazol-5-yl)ethane-1,2-diamine
CID 63758915
3-[[(1-methyltetrazol-5-yl)amino]methyl]hexan-1-ol
CID 103705100
N-(2-methylpropyl)-2-[(1-methyltetrazol-5-yl)amino]acetamide
CID 115618185
2-[(1-methyltetrazol-5-yl)amino]ethanol
CID 63152176
N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine
CID 63152406
N'-methyl-N-(1-methyltetrazol-5-yl)-N'-propan-2-ylbutane-1,4-diamine
CID 63150397
N'-(1-methyltetrazol-5-yl)butane-1,4-diamine
CID 63152546
5-(1-chloroethyl)-N-(3-methyl-2-propan-2-ylbutyl)-1,3,4-oxadiazol-2-amine
CID 106958769

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine?
The IUPAC name of 1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine (CID 102913752) is 1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine.
What is the SMILES notation for 1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine?
The canonical SMILES for 1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine is CC(C)C(CNc1nnnn1C)C(C)C.
What is the InChIKey of 1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine?
The InChIKey is LLIWKLJRHBQVBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N5/c1-7(2)9(8(3)4)6-11-10-12-13-14-15(10)5/h7-9H,6H2,1-5H3,(H,11,12,14).
What are the key properties of 1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine?
1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine has a molecular weight of 211.31 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine is sourced from PubChem (CID 102913752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).