N-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine

C13H21N3 — CID 115213588

IUPACN-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine
SMILESCNC1CCC(CNc2ccccn2)CC1
InChIInChI=1S/C13H21N3/c1-14-12-7-5-11(6-8-12)10-16-13-4-2-3-9-15-13/h2-4,9,11-12,14H,5-8,10H2,1H3,(H,15,16)
InChIKeyBVTJLPDHJQVMHA-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.27
Rot. Bonds4

About N-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine

N-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine (PubChem CID 115213588) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is N-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine
PubChem CID115213588
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC NameN-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine
SMILESCNC1CCC(CNc2ccccn2)CC1
InChIInChI=1S/C13H21N3/c1-14-12-7-5-11(6-8-12)10-16-13-4-2-3-9-15-13/h2-4,9,11-12,14H,5-8,10H2,1H3,(H,15,16)
InChIKeyBVTJLPDHJQVMHA-UHFFFAOYSA-N
XLogP2.27
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopropanecarbaldehyde;N-(cyclopropylmethyl)pyridin-2-amine
CID 157157680
N-(piperidin-4-ylmethyl)pyridin-2-amine;trihydrochloride
CID 162422883
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyridin-2-amine
CID 61012196
N-[[4-(methylamino)cyclohexyl]methyl]pyridin-4-amine
CID 115213590
N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridin-2-amine
CID 61209300
N-[(1,1-dioxothiolan-2-yl)methyl]pyridin-2-amine
CID 81040808
N-[(3,5-dimethylpyrazolidin-4-yl)methyl]pyridin-2-amine
CID 133269613
N-[[(3R)-1-[(4-methoxyphenyl)methyl]pyrrolidin-3-yl]methyl]pyridin-2-amine
CID 124595693
N-[[(3R)-1-[(5-ethoxy-1,3,4-thiadiazol-2-yl)methyl]pyrrolidin-3-yl]methyl]pyridin-2-amine
CID 95137123
1,3-dimethylpyrrolidine;N-methyl-N'-pyridin-2-ylmethanediamine
CID 143564879
N-[[(3S)-1-(6-ethoxypyrimidin-4-yl)pyrrolidin-3-yl]methyl]pyridin-2-amine
CID 99638683
N-[[1-(5,6-dimethyl-1,2,4-triazin-3-yl)pyrrolidin-3-yl]methyl]pyridin-2-amine
CID 86798079

Frequently Asked Questions

What is the IUPAC name of N-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine?
The IUPAC name of N-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine (CID 115213588) is N-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine.
What is the SMILES notation for N-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine?
The canonical SMILES for N-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine is CNC1CCC(CNc2ccccn2)CC1.
What is the InChIKey of N-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine?
The InChIKey is BVTJLPDHJQVMHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-14-12-7-5-11(6-8-12)10-16-13-4-2-3-9-15-13/h2-4,9,11-12,14H,5-8,10H2,1H3,(H,15,16).
What are the key properties of N-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine?
N-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine has a molecular weight of 219.33 g/mol, XLogP of 2.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(methylamino)cyclohexyl]methyl]pyridin-2-amine is sourced from PubChem (CID 115213588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).