(1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine

C14H18N2O — CID 105488420

IUPAC(1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine
SMILESCOc1cccc2c1cc1n2CC(CN)CC1
InChIInChI=1S/C14H18N2O/c1-17-14-4-2-3-13-12(14)7-11-6-5-10(8-15)9-16(11)13/h2-4,7,10H,5-6,8-9,15H2,1H3
InChIKeyHYAKRSRJYLRRNQ-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.17
Rot. Bonds2

About (1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine

(1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine (PubChem CID 105488420) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is (1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine.

Molecular Properties

Compound Name(1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine
PubChem CID105488420
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name(1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine
SMILESCOc1cccc2c1cc1n2CC(CN)CC1
InChIInChI=1S/C14H18N2O/c1-17-14-4-2-3-13-12(14)7-11-6-5-10(8-15)9-16(11)13/h2-4,7,10H,5-6,8-9,15H2,1H3
InChIKeyHYAKRSRJYLRRNQ-UHFFFAOYSA-N
XLogP2.17
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine
CID 105488424
(5-methoxy-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine
CID 105469922
1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-8-amine
CID 105469893
[3-[(2-methoxyphenyl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-6-yl]methanamine
CID 105392089
(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine;hydrochloride
CID 19888691
(4-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-8-yl)methanamine
CID 105488431
(1-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indol-8-yl)methanamine
CID 105468047
5-methoxy-1,2-dihydropyrrolo[1,2-a]indol-3-one
CID 19927834
[3-(2,4-dimethoxyphenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-6-yl]methanamine
CID 105392236
[5-(2-cyclopentyloxy-3-methoxyphenyl)-1-methylpyrrolidin-3-yl]methanamine
CID 117489816
[3-[(3-methoxyphenyl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-6-yl]methanamine
CID 105392071
[5-(3-methoxy-2-propan-2-yloxyphenyl)-1-methylpyrrolidin-3-yl]methanamine
CID 117446721

Frequently Asked Questions

What is the IUPAC name of (1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine?
The IUPAC name of (1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine (CID 105488420) is (1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine.
What is the SMILES notation for (1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine?
The canonical SMILES for (1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine is COc1cccc2c1cc1n2CC(CN)CC1.
What is the InChIKey of (1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine?
The InChIKey is HYAKRSRJYLRRNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-17-14-4-2-3-13-12(14)7-11-6-5-10(8-15)9-16(11)13/h2-4,7,10H,5-6,8-9,15H2,1H3.
What are the key properties of (1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine?
(1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine has a molecular weight of 230.31 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine is sourced from PubChem (CID 105488420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).