N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine

C14H21N3 — CID 105074049

IUPACN-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine
SMILESCNCc1ccncc1N(CC1CC1)C1CC1
InChIInChI=1S/C14H21N3/c1-15-8-12-6-7-16-9-14(12)17(13-4-5-13)10-11-2-3-11/h6-7,9,11,13,15H,2-5,8,10H2,1H3
InChIKeyZRKBNYZICJYIMM-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.18
Rot. Bonds6

About N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine

N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine (PubChem CID 105074049) has the molecular formula C14H21N3 and a molecular weight of 231.34 g/mol. Its IUPAC name is N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine
PubChem CID105074049
Molecular FormulaC14H21N3
Molecular Weight231.34 g/mol
Exact Mass231.17
IUPAC NameN-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine
SMILESCNCc1ccncc1N(CC1CC1)C1CC1
InChIInChI=1S/C14H21N3/c1-15-8-12-6-7-16-9-14(12)17(13-4-5-13)10-11-2-3-11/h6-7,9,11,13,15H,2-5,8,10H2,1H3
InChIKeyZRKBNYZICJYIMM-UHFFFAOYSA-N
XLogP2.18
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine?
The IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine (CID 105074049) is N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine.
What is the SMILES notation for N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine?
The canonical SMILES for N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine is CNCc1ccncc1N(CC1CC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine?
The InChIKey is ZRKBNYZICJYIMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3/c1-15-8-12-6-7-16-9-14(12)17(13-4-5-13)10-11-2-3-11/h6-7,9,11,13,15H,2-5,8,10H2,1H3.
What are the key properties of N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine?
N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine has a molecular weight of 231.34 g/mol, XLogP of 2.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine is sourced from PubChem (CID 105074049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).