(4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine

C12H17N — CID 115014565

IUPAC(4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine
SMILESCc1ccc(CN)c2c1CCCC2
InChIInChI=1S/C12H17N/c1-9-6-7-10(8-13)12-5-3-2-4-11(9)12/h6-7H,2-5,8,13H2,1H3
InChIKeyVVZQBDPWWSVMDH-UHFFFAOYSA-N
MW175.28 g/mol
LogP2.33
Rot. Bonds1

About (4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine

(4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine (PubChem CID 115014565) has the molecular formula C12H17N and a molecular weight of 175.28 g/mol. Its IUPAC name is (4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine.

Molecular Properties

Compound Name(4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine
PubChem CID115014565
Molecular FormulaC12H17N
Molecular Weight175.28 g/mol
Exact Mass175.14
IUPAC Name(4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine
SMILESCc1ccc(CN)c2c1CCCC2
InChIInChI=1S/C12H17N/c1-9-6-7-10(8-13)12-5-3-2-4-11(9)12/h6-7H,2-5,8,13H2,1H3
InChIKeyVVZQBDPWWSVMDH-UHFFFAOYSA-N
XLogP2.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.28
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

butane;ethane;5-ethyl-8-methyl-1,2,3,4-tetrahydronaphthalene
CID 142179547
(7-methyl-2,3-dihydro-1H-inden-4-yl)methanol
CID 117276140
2-(7-methyl-2,3-dihydro-1H-inden-4-yl)acetic acid
CID 117281877
4-(4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)butanoic acid
CID 117336753
1-ethyl-4-[(4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methyl]naphthalene
CID 143195979
ethyl 4-methyl-5,6,7,8-tetrahydronaphthalene-1-carboxylate
CID 24974859
1,4-dipropyl-6,7,8,9-tetrahydro-5H-benzo[7]annulene
CID 139941681
4-(aminomethyl)-3-methylbenzenecarbothioic S-acid
CID 86120891
[2-(2,5-dimethylphenoxy)-4-methylphenyl]methanamine
CID 62308844
(1R)-1-(7-methyl-2,3-dihydro-1H-inden-4-yl)propan-1-amine
CID 130655075
[2-methyl-5-(piperidin-1-ylmethyl)phenyl]methanamine
CID 125454284
1-(4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)ethanol
CID 117282016

Frequently Asked Questions

What is the IUPAC name of (4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine?
The IUPAC name of (4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine (CID 115014565) is (4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine.
What is the SMILES notation for (4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine?
The canonical SMILES for (4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine is Cc1ccc(CN)c2c1CCCC2.
What is the InChIKey of (4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine?
The InChIKey is VVZQBDPWWSVMDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N/c1-9-6-7-10(8-13)12-5-3-2-4-11(9)12/h6-7H,2-5,8,13H2,1H3.
What are the key properties of (4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine?
(4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine has a molecular weight of 175.28 g/mol, XLogP of 2.33, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanamine is sourced from PubChem (CID 115014565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).