N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine

C10H18N4 — CID 107053262

IUPACN-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine
SMILESCNCC1(Cc2cn(C)nn2)CCC1
InChIInChI=1S/C10H18N4/c1-11-8-10(4-3-5-10)6-9-7-14(2)13-12-9/h7,11H,3-6,8H2,1-2H3
InChIKeyPTSMKTPNFQKFAW-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.75
Rot. Bonds4

About N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine

N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine (PubChem CID 107053262) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine
PubChem CID107053262
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC NameN-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine
SMILESCNCC1(Cc2cn(C)nn2)CCC1
InChIInChI=1S/C10H18N4/c1-11-8-10(4-3-5-10)6-9-7-14(2)13-12-9/h7,11H,3-6,8H2,1-2H3
InChIKeyPTSMKTPNFQKFAW-UHFFFAOYSA-N
XLogP0.75
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methyl]propan-1-amine
CID 107053273
[1-[(1-methyltriazol-4-yl)methyl]cyclooctyl]methanamine
CID 107057461
1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol
CID 107045687
1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol
CID 107045659
N,N-dimethyl-1-[[(1-methyltriazol-4-yl)methylamino]methyl]cyclobutan-1-amine
CID 105415593
N-[(1-methylsulfanylcyclobutyl)methyl]-1-(1-methyltriazol-4-yl)methanamine
CID 107267202
1-[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclobutyl]-N-methylmethanamine
CID 115334382
[1-[(1-methyltriazol-4-yl)methyl]-4-propan-2-ylcyclohexyl]methanamine
CID 107057422
2-methoxy-N-[[3-[(1-methyltriazol-4-yl)methyl]-3-bicyclo[3.1.0]hexanyl]methyl]ethanamine
CID 107053522
1-methyl-4-[[3-(2-methylpropyl)azetidin-3-yl]methyl]triazole
CID 107058600
2-ethyl-1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-amine
CID 107046702
4-[(1-methyltriazol-4-yl)methyl]oxane-4-carbonitrile
CID 107057305

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine?
The IUPAC name of N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine (CID 107053262) is N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine.
What is the SMILES notation for N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine?
The canonical SMILES for N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine is CNCC1(Cc2cn(C)nn2)CCC1.
What is the InChIKey of N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine?
The InChIKey is PTSMKTPNFQKFAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-11-8-10(4-3-5-10)6-9-7-14(2)13-12-9/h7,11H,3-6,8H2,1-2H3.
What are the key properties of N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine?
N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine has a molecular weight of 194.28 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methanamine is sourced from PubChem (CID 107053262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).