(5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine

C13H20N2 — CID 83861221

IUPAC(5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine
SMILESCc1ccc2c(c1)C(CN)CN2C(C)C
InChIInChI=1S/C13H20N2/c1-9(2)15-8-11(7-14)12-6-10(3)4-5-13(12)15/h4-6,9,11H,7-8,14H2,1-3H3
InChIKeyKZXQAGWJXMXUIF-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.27
Rot. Bonds2

About (5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine

(5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine (PubChem CID 83861221) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is (5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine.

Molecular Properties

Compound Name(5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine
PubChem CID83861221
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name(5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine
SMILESCc1ccc2c(c1)C(CN)CN2C(C)C
InChIInChI=1S/C13H20N2/c1-9(2)15-8-11(7-14)12-6-10(3)4-5-13(12)15/h4-6,9,11H,7-8,14H2,1-3H3
InChIKeyKZXQAGWJXMXUIF-UHFFFAOYSA-N
XLogP2.27
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-fluoro-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine
CID 83861224
(5-chloro-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine
CID 83868804
6-methyl-1-propan-2-yl-2,3-dihydroindol-3-amine
CID 83753003
3-(5-chloro-1-propan-2-yl-2,3-dihydroindol-3-yl)propan-1-amine
CID 117202274
1-(5-fluoro-1-propan-2-yl-2,3-dihydroindol-3-yl)propan-2-amine
CID 115006256
O-[(5-methoxy-1-propan-2-yl-2,3-dihydroindol-3-yl)methyl]hydroxylamine
CID 117202572
O-[[1-propan-2-yl-5-(trifluoromethyl)-2,3-dihydroindol-3-yl]methyl]hydroxylamine
CID 117201719
(4-chloro-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine
CID 117200097
2-(5-methoxy-1-propan-2-yl-2,3-dihydroindol-3-yl)-N-methylethanamine
CID 117202601
6-methyl-1,4-di(propan-2-yl)-2,3-dihydroquinoxaline
CID 22041393
2-(5-methoxy-1-propan-2-yl-2,3-dihydroindol-3-yl)-N,N-dimethylethanamine
CID 169244252
3-(5-chloro-1-propan-2-yl-2,3-dihydroindol-3-yl)-2-methylpropanoic acid
CID 117202310

Frequently Asked Questions

What is the IUPAC name of (5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine?
The IUPAC name of (5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine (CID 83861221) is (5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine.
What is the SMILES notation for (5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine?
The canonical SMILES for (5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine is Cc1ccc2c(c1)C(CN)CN2C(C)C.
What is the InChIKey of (5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine?
The InChIKey is KZXQAGWJXMXUIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-9(2)15-8-11(7-14)12-6-10(3)4-5-13(12)15/h4-6,9,11H,7-8,14H2,1-3H3.
What are the key properties of (5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine?
(5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine has a molecular weight of 204.32 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine is sourced from PubChem (CID 83861221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).