N-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine

C14H20N2 — CID 117185996

IUPACN-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine
SMILESCNCc1cc2ccc(C)cc2n1C(C)C
InChIInChI=1S/C14H20N2/c1-10(2)16-13(9-15-4)8-12-6-5-11(3)7-14(12)16/h5-8,10,15H,9H2,1-4H3
InChIKeyBMNQLJLVFBGKAP-UHFFFAOYSA-N
MW216.33 g/mol
LogP3.25
Rot. Bonds3

About N-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine

N-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine (PubChem CID 117185996) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is N-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine
PubChem CID117185996
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC NameN-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine
SMILESCNCc1cc2ccc(C)cc2n1C(C)C
InChIInChI=1S/C14H20N2/c1-10(2)16-13(9-15-4)8-12-6-5-11(3)7-14(12)16/h5-8,10,15H,9H2,1-4H3
InChIKeyBMNQLJLVFBGKAP-UHFFFAOYSA-N
XLogP3.25
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(6-methyl-1-propan-2-ylindol-2-yl)methanamine
CID 117122698
2-(ethoxymethyl)-6-methyl-1-propan-2-ylindole
CID 117186061
6-methyl-2-[(4-methylpiperazin-1-yl)methyl]-1-propan-2-ylindole
CID 117186009
1-(5-methoxy-1-propan-2-ylindol-2-yl)-N-methylmethanamine
CID 83860149
N-methyl-1-(5-methyl-1-propan-2-ylindol-2-yl)propan-2-amine
CID 117195171
3-[(6-methyl-1-propan-2-ylindol-2-yl)methoxy]phenol
CID 117186036
2-(ethylaminomethyl)-1-propan-2-ylindol-6-amine
CID 117180819
1-(4-fluoro-1-propan-2-ylindol-2-yl)-N-methylmethanamine
CID 117173709
1-propan-2-yl-2-[(propan-2-ylamino)methyl]indole-6-carboxylic acid
CID 117180923
2-[(cyclopropylamino)methyl]-1-propan-2-ylindol-6-ol
CID 117180534
2-[(3-methylphenoxy)methyl]-1-propan-2-ylindol-6-amine
CID 117180699
2-[(cyclopropylamino)methyl]-1-propan-2-ylindole-6-carboxylic acid
CID 117180869

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine?
The IUPAC name of N-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine (CID 117185996) is N-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine is CNCc1cc2ccc(C)cc2n1C(C)C.
What is the InChIKey of N-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine?
The InChIKey is BMNQLJLVFBGKAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-10(2)16-13(9-15-4)8-12-6-5-11(3)7-14(12)16/h5-8,10,15H,9H2,1-4H3.
What are the key properties of N-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine?
N-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine has a molecular weight of 216.33 g/mol, XLogP of 3.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(6-methyl-1-propan-2-ylindol-2-yl)methanamine is sourced from PubChem (CID 117185996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).